Compound C29H39Cl2N3O2

3-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dichloride

CAS: 80785-10-0

Molecular Formula	`C29H39Cl2N3O2`
Molecular Weight	532.5 g/mol
Topological Polar Surface Area	48.9 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	12
Exact Mass	531.24194
Heavy Atoms	36
Complexity	564.0

Chemical Identifiers

CAS Number	80785-10-0
SMILES	`CC(C)[NH+](CCCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC=C(C=C3)OC)C(C)C.[Cl-].[Cl-]`
InChIKey	`NZSWOCKGDRTOKT-UHFFFAOYSA-N`

📖 Product Overview

Compound C29H39Cl2N3O2 (CAS: 80785-10-0) is a chemical compound with molecular formula C29H39Cl2N3O2 and molecular weight 532.5 g/mol. Its IUPAC systematic name is 3-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dichloride. Topological Polar Surface Area 48.9 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 12 Exact Mass 531.24194 Heavy Atoms 36 Complexity 564.0 InChI Key: NZSWOCKGDRTOKT-UHFFFAOYSA-N. SMILES: CC(C)[NH+](CCCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC=C(C=C3)OC)C(C)C.[Cl-].[Cl-].

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