4-[[6-chloranyl-1-(diphenylmethyl)indol-3-yl]methyl]-3-(3-oxidanylpropoxy)benzoic acid

Systemtic Name: 4-[[6-chloranyl-1-(diphenylmethyl)indol-3-yl]methyl]-3-(3-oxidanylpropoxy)benzoic acid Openeye Name: 4-[(1-benzhydryl-6-chloro-indol-3-yl)methyl]-3-(3-hydroxypropoxy)benzoic acid CAS Name: 4-[[6-chloro-1-(diphenylmethyl)-3-indolyl]methyl]-3-(3-hydroxypropoxy)benzoic acid IUPAC Name: 4-[(1-benzhydryl-6-chloroindol-3-yl)methyl]-3-(3-hydroxypropoxy)benzoic acid Traditional Name: 4-[(1-benzhydryl-6-chloro-indol-3-yl)methyl]-3-(3-hydroxypropoxy)benzoic acid Formula: C32H28ClNO4 MolecularWeight: 526.02202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C=C(C4=C3C=C(C=C4)Cl)CC5=C(C=C(C=C5)C(=O)O)OCCCO

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C=C(C4=C3C=C(C=C4)Cl)CC5=C(C=C(C=C5)C(=O)O)OCCCO

InChI

InChI=1S/C32H28ClNO4/c33-27-14-15-28-26(18-24-12-13-25(32(36)37)19-30(24)38-17-7-16-35)21-34(29(28)20-27)31(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-6,8-15,19-21,31,35H,7,16-18H2,(H,36,37)