2-(3,4-dimethoxyphenyl)-3-[(3-nitrophenyl)amino]inden-1-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-[(3-nitrophenyl)amino]inden-1-one Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one CAS Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)-1-indenone IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one Traditional Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H18N2O5/c1-29-19-11-10-14(12-20(19)30-2)21-22(17-8-3-4-9-18(17)23(21)26)24-15-6-5-7-16(13-15)25(27)28/h3-13,24H,1-2H3