N-(4-ethoxy-3-methoxy-phenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide

Systemtic Name: N-(4-ethoxy-3-methoxy-phenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide Openeye Name: 4-(benzylamino)-N-(4-ethoxy-3-methoxy-phenyl)-3-nitro-benzamide CAS Name: N-(4-ethoxy-3-methoxyphenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide IUPAC Name: 4-(benzylamino)-N-(4-ethoxy-3-methoxyphenyl)-3-nitrobenzamide Traditional Name: 4-(benzylamino)-N-(4-ethoxy-3-methoxy-phenyl)-3-nitro-benzamide Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H23N3O5/c1-3-31-21-12-10-18(14-22(21)30-2)25-23(27)17-9-11-19(20(13-17)26(28)29)24-15-16-7-5-4-6-8-16/h4-14,24H,3,15H2,1-2H3,(H,25,27)