4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-benzaldehyde

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-benzaldehyde Openeye Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-benzaldehyde CAS Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitrobenzaldehyde IUPAC Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-(veratrylamino)benzaldehyde Formula: C16H16N2O5 MolecularWeight: 316.30864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)C=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)C=O)[N+](=O)[O-])OC

InChI

InChI=1S/C16H16N2O5/c1-22-15-6-4-11(8-16(15)23-2)9-17-13-5-3-12(10-19)7-14(13)18(20)21/h3-8,10,17H,9H2,1-2H3