methyl 3-[(1-methylindol-3-yl)-(4-nitrophenyl)methyl]-4-oxidanyl-benzoate

Systemtic Name: methyl 3-[(1-methylindol-3-yl)-(4-nitrophenyl)methyl]-4-oxidanyl-benzoate Openeye Name: methyl 4-hydroxy-3-[(1-methylindol-3-yl)-(4-nitrophenyl)methyl]benzoate CAS Name: 4-hydroxy-3-[(1-methyl-3-indolyl)-(4-nitrophenyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-[(1-methylindol-3-yl)-(4-nitrophenyl)methyl]benzoate Traditional Name: 4-hydroxy-3-[(1-methylindol-3-yl)-(4-nitrophenyl)methyl]benzoic acid methyl ester Formula: C24H20N2O5 MolecularWeight: 416.426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(C3=CC=C(C=C3)[N+](=O)[O-])C4=C(C=CC(=C4)C(=O)OC)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(C3=CC=C(C=C3)[N+](=O)[O-])C4=C(C=CC(=C4)C(=O)OC)O

InChI

InChI=1S/C24H20N2O5/c1-25-14-20(18-5-3-4-6-21(18)25)23(15-7-10-17(11-8-15)26(29)30)19-13-16(24(28)31-2)9-12-22(19)27/h3-14,23,27H,1-2H3