3-cyclohexyl-1-methyl-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-methyl-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-cyclohexyl-1-methyl-indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-methyl-2-(4-phenylmethoxyphenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-methyl-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-cyclohexyl-1-methyl-indole-6-carboxylic acid Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C29H29NO3/c1-30-26-18-23(29(31)32)14-17-25(26)27(21-10-6-3-7-11-21)28(30)22-12-15-24(16-13-22)33-19-20-8-4-2-5-9-20/h2,4-5,8-9,12-18,21H,3,6-7,10-11,19H2,1H3,(H,31,32)