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

Systemtic Name: 1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(2-methylpropyl)-4-phenyl-3H-indole-2-carboxylic acid Openeye Name: 1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-phenyl-indoline-2-carboxylic acid CAS Name: 1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-2-(2-methylpropyl)-4-phenyl-3H-indole-2-carboxylic acid IUPAC Name: 1-(4-tert-butyl-3-methoxybenzoyl)-2-(2-methylpropyl)-4-phenyl-3H-indole-2-carboxylic acid Traditional Name: 1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-phenyl-indoline-2-carboxylic acid Formula: C31H35NO4 MolecularWeight: 485.6139

Click to see the large picture

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)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)CC1(CC2=C(C=CC=C2N1C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C31H35NO4/c1-20(2)18-31(29(34)35)19-24-23(21-11-8-7-9-12-21)13-10-14-26(24)32(31)28(33)22-15-16-25(30(3,4)5)27(17-22)36-6/h7-17,20H,18-19H2,1-6H3,(H,34,35)