3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-cyclohexyl-1-(2-morpholino-2-oxo-ethyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-(4-morpholinyl)-2-oxoethyl]-2-(4-phenylmethoxyphenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-(2-morpholin-4-yl-2-oxoethyl)-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-cyclohexyl-1-(2-keto-2-morpholino-ethyl)indole-6-carboxylic acid Formula: C34H36N2O5 MolecularWeight: 552.66004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)OCC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C34H36N2O5/c37-31(35-17-19-40-20-18-35)22-36-30-21-27(34(38)39)13-16-29(30)32(25-9-5-2-6-10-25)33(36)26-11-14-28(15-12-26)41-23-24-7-3-1-4-8-24/h1,3-4,7-8,11-16,21,25H,2,5-6,9-10,17-20,22-23H2,(H,38,39)