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

Systemtic Name: 3-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-indole-6-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-cyclohexyl-1H-indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-indole-6-carboxylic acid IUPAC Name: 3-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-indole-6-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-cyclohexyl-1H-indole-6-carboxylic acid Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(NC3=C2C=CC(=C3)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(NC3=C2C=CC(=C3)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H27NO3/c30-28(31)22-13-16-24-25(17-22)29-27(26(24)20-9-5-2-6-10-20)21-11-14-23(15-12-21)32-18-19-7-3-1-4-8-19/h1,3-4,7-8,11-17,20,29H,2,5-6,9-10,18H2,(H,30,31)