AC1NLDMM structure

AC1NLDMM

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(2-methylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-7-olate

Also Known As: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(2-methylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-7-olate|3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-8-[(2-methyl-1-piperidinyl)methyl]-4H-chromen-4-one|3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate

CAS: 637751-96-3
Molecular Formula C24H25NO5
Molecular Weight 407.17328 g/mol
LogP 2.2621
Topological Polar Surface Area 76.17 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 407.17328
Monoisotopic Mass 407.17328
Heavy Atoms 30
Complexity 1152.2769

Chemical Identifiers

CAS Number 637751-96-3
SMILES CC1CCCC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCCO5)[O-]

Product Overview

AC1NLDMM (CAS 637751-96-3), with molecular formula C24H25NO5 and molecular weight 407.17328 g/mol. IUPAC: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(2-methylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-7-olate.

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