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

Systemtic Name: 4-[[4-chloranyl-1-(diphenylmethyl)indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[(1-benzhydryl-4-chloro-indol-3-yl)methyl]-3-methoxy-benzoic acid CAS Name: 4-[[4-chloro-1-(diphenylmethyl)-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(1-benzhydryl-4-chloroindol-3-yl)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(1-benzhydryl-4-chloro-indol-3-yl)methyl]-3-methoxy-benzoic acid Formula: C30H24ClNO3 MolecularWeight: 481.96946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CC2=CN(C3=C2C(=CC=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CC2=CN(C3=C2C(=CC=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H24ClNO3/c1-35-27-18-23(30(33)34)16-15-22(27)17-24-19-32(26-14-8-13-25(31)28(24)26)29(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-16,18-19,29H,17H2,1H3,(H,33,34)