methyl 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butanoate

Systemtic Name: methyl 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butanoate Openeye Name: methyl 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butanoate CAS Name: 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butanoic acid methyl ester IUPAC Name: methyl 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butanoate Traditional Name: 2-(1H-indol-3-yl)-4-nitro-3-(2-phenyl-1H-indol-3-yl)butyric acid methyl ester Formula: C27H23N3O4 MolecularWeight: 453.48922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CNC2=CC=CC=C21)C(C[N+](=O)[O-])C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C(C1=CNC2=CC=CC=C21)C(C[N+](=O)[O-])C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O4/c1-34-27(31)25(20-15-28-22-13-7-5-11-18(20)22)21(16-30(32)33)24-19-12-6-8-14-23(19)29-26(24)17-9-3-2-4-10-17/h2-15,21,25,28-29H,16H2,1H3