[(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 3,5-dimethoxybenzoate

Systemtic Name: [(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 3,5-dimethoxybenzoate Openeye Name: [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] ester IUPAC Name: [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] ester Formula: C21H17N3O6 MolecularWeight: 407.37618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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