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

Systemtic Name: 1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(2-carboxyethyl)-2-(2-methylpropyl)-3H-indole-2-carboxylic acid Openeye Name: 1-(4-tert-butyl-3-methoxy-benzoyl)-4-(2-carboxyethyl)-2-isobutyl-indoline-2-carboxylic acid CAS Name: 1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-4-(2-carboxyethyl)-2-(2-methylpropyl)-3H-indole-2-carboxylic acid IUPAC Name: 1-(4-tert-butyl-3-methoxybenzoyl)-4-(2-carboxyethyl)-2-(2-methylpropyl)-3H-indole-2-carboxylic acid Traditional Name: 1-(4-tert-butyl-3-methoxy-benzoyl)-4-(2-carboxyethyl)-2-isobutyl-indoline-2-carboxylic acid Formula: C28H35NO6 MolecularWeight: 481.5806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC2=C(C=CC=C2N1C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)CCC(=O)O)C(=O)O

Isomeric SMILES

CC(C)CC1(CC2=C(C=CC=C2N1C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)CCC(=O)O)C(=O)O

InChI

InChI=1S/C28H35NO6/c1-17(2)15-28(26(33)34)16-20-18(11-13-24(30)31)8-7-9-22(20)29(28)25(32)19-10-12-21(27(3,4)5)23(14-19)35-6/h7-10,12,14,17H,11,13,15-16H2,1-6H3,(H,30,31)(H,33,34)