4-[[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]methyl]benzoic acid Openeye Name: 4-[(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)methyl]benzoic acid CAS Name: 4-[[5-chloro-1-(diphenylmethyl)-2-methyl-3-indolyl]methyl]benzoic acid IUPAC Name: 4-[(1-benzhydryl-5-chloro-2-methylindol-3-yl)methyl]benzoic acid Traditional Name: 4-[(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)methyl]benzoic acid Formula: C30H24ClNO2 MolecularWeight: 465.97006

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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)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(C3=CC=CC=C3)C4=CC=CC=C4)C=CC(=C2)Cl)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C30H24ClNO2/c1-20-26(18-21-12-14-24(15-13-21)30(33)34)27-19-25(31)16-17-28(27)32(20)29(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-17,19,29H,18H2,1H3,(H,33,34)