1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(2-methylpropoxy)-2-(phenylmethyl)-3H-indole-2-carboxylic acid

Systemtic Name: 1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(2-methylpropoxy)-2-(phenylmethyl)-3H-indole-2-carboxylic acid Openeye Name: 2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-4-isobutoxy-indoline-2-carboxylic acid CAS Name: 1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-4-(2-methylpropoxy)-2-(phenylmethyl)-3H-indole-2-carboxylic acid IUPAC Name: 2-benzyl-1-(4-tert-butyl-3-methoxybenzoyl)-4-(2-methylpropoxy)-3H-indole-2-carboxylic acid Traditional Name: 2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-4-isobutoxy-indoline-2-carboxylic acid Formula: C32H37NO5 MolecularWeight: 515.63988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC2=C1CC(N2C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)COC1=CC=CC2=C1CC(N2C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C32H37NO5/c1-21(2)20-38-27-14-10-13-26-24(27)19-32(30(35)36,18-22-11-8-7-9-12-22)33(26)29(34)23-15-16-25(31(3,4)5)28(17-23)37-6/h7-17,21H,18-20H2,1-6H3,(H,35,36)