methyl 4-[[3-[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-[5-chloro-1-(diphenylmethyl)-2-methyl-3-indolyl]-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1-benzhydryl-5-chloro-2-methylindol-3-yl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)propanoylamino]methyl]benzoic acid methyl ester Formula: C34H31ClN2O3 MolecularWeight: 551.07454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(C3=CC=CC=C3)C4=CC=CC=C4)C=CC(=C2)Cl)CCC(=O)NCC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1C(C3=CC=CC=C3)C4=CC=CC=C4)C=CC(=C2)Cl)CCC(=O)NCC5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C34H31ClN2O3/c1-23-29(18-20-32(38)36-22-24-13-15-27(16-14-24)34(39)40-2)30-21-28(35)17-19-31(30)37(23)33(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-17,19,21,33H,18,20,22H2,1-2H3,(H,36,38)