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

Systemtic Name: methyl 4-[[2-[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[5-chloro-1-(diphenylmethyl)-2-methyl-3-indolyl]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(1-benzhydryl-5-chloro-2-methylindol-3-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C33H29ClN2O3 MolecularWeight: 537.04796

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H29ClN2O3/c1-22-28(20-31(37)35-21-23-13-15-26(16-14-23)33(38)39-2)29-19-27(34)17-18-30(29)36(22)32(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-19,32H,20-21H2,1-2H3,(H,35,37)