ethyl 1-(2-nitrophenyl)-3-(phenylmethyl)indole-2-carboxylate

Systemtic Name: ethyl 1-(2-nitrophenyl)-3-(phenylmethyl)indole-2-carboxylate Openeye Name: ethyl 3-benzyl-1-(2-nitrophenyl)indole-2-carboxylate CAS Name: 1-(2-nitrophenyl)-3-(phenylmethyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-1-(2-nitrophenyl)indole-2-carboxylate Traditional Name: 3-benzyl-1-(2-nitrophenyl)indole-2-carboxylic acid ethyl ester Formula: C24H20N2O4 MolecularWeight: 400.4266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4/c1-2-30-24(27)23-19(16-17-10-4-3-5-11-17)18-12-6-7-13-20(18)25(23)21-14-8-9-15-22(21)26(28)29/h3-15H,2,16H2,1H3