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

Systemtic Name: 4-[[6-chloranyl-1-(diphenylmethyl)indol-3-yl]methyl]-3-oxidanyl-benzoic acid Openeye Name: 4-[(1-benzhydryl-6-chloro-indol-3-yl)methyl]-3-hydroxy-benzoic acid CAS Name: 4-[[6-chloro-1-(diphenylmethyl)-3-indolyl]methyl]-3-hydroxybenzoic acid IUPAC Name: 4-[(1-benzhydryl-6-chloroindol-3-yl)methyl]-3-hydroxybenzoic acid Traditional Name: 4-[(1-benzhydryl-6-chloro-indol-3-yl)methyl]-3-hydroxy-benzoic acid Formula: C29H22ClNO3 MolecularWeight: 467.94288

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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)O

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)O

InChI

InChI=1S/C29H22ClNO3/c30-24-13-14-25-23(15-21-11-12-22(29(33)34)16-27(21)32)18-31(26(25)17-24)28(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,16-18,28,32H,15H2,(H,33,34)