[(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 3,4-dimethoxybenzoate

Systemtic Name: [(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 3,4-dimethoxybenzoate Openeye Name: [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] ester IUPAC Name: [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] ester Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O/N=C(\C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=NC=C3)OC

InChI

InChI=1S/C21H17N3O6/c1-28-18-8-5-16(13-19(18)29-2)21(25)30-23-20(15-9-11-22-12-10-15)14-3-6-17(7-4-14)24(26)27/h3-13H,1-2H3/b23-20+