RefChem:513689 structure

RefChem:513689

(4E)-1-[2-(diethylamino)ethyl]-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione

Also Known As: 4-(4-(Benzyloxy)-2-methylbenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one|4-[4-(benzyloxy)-2-methylbenzoyl]-1-[2-(diethylamino)ethyl]-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one|(4E)-1-(2-diethylaminoethyl)-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione|4-(4-(BENZYLOXY)-2-METHYLBENZOYL)-1-(2-(DIETHYLAMINO)ETHYL)-3-HYDROXY-5-(3-NITROPHENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE|4-{[4-(benzyloxy)-2-methylphenyl]carbonyl}-1-[2-(diethylamino)ethyl]-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one|646-211-7

CAS: 496799-45-2
Molecular Formula C31H33N3O6
Molecular Weight 543.23694 g/mol
LogP 5.24572
Topological Polar Surface Area 113.22 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 11
Exact Mass 543.23694
Monoisotopic Mass 543.23694
Heavy Atoms 40
Complexity 1431.993

Chemical Identifiers

CAS Number 496799-45-2
SMILES CCN(CC)CCN1C(/C(=C(/C2=C(C=C(C=C2)OCC3=CC=CC=C3)C)\O)/C(=O)C1=O)C4=CC(=CC=C4)[N+](=O)[O-]

Product Overview

RefChem:513689 (CAS 496799-45-2), with molecular formula C31H33N3O6 and molecular weight 543.23694 g/mol. IUPAC: (4E)-1-[2-(diethylamino)ethyl]-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.

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