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

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(phenylmethyl)-3H-indole-2-carboxylic acid Openeye Name: 4-(2-amino-2-oxo-ethoxy)-2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)indoline-2-carboxylic acid CAS Name: 4-(2-amino-2-oxoethoxy)-1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-2-(phenylmethyl)-3H-indole-2-carboxylic acid IUPAC Name: 4-(2-amino-2-oxoethoxy)-2-benzyl-1-(4-tert-butyl-3-methoxybenzoyl)-3H-indole-2-carboxylic acid Traditional Name: 4-(2-amino-2-keto-ethoxy)-2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)indoline-2-carboxylic acid Formula: C30H32N2O6 MolecularWeight: 516.58488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C3=C(CC2(CC4=CC=CC=C4)C(=O)O)C(=CC=C3)OCC(=O)N)OC

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C3=C(CC2(CC4=CC=CC=C4)C(=O)O)C(=CC=C3)OCC(=O)N)OC

InChI

InChI=1S/C30H32N2O6/c1-29(2,3)22-14-13-20(15-25(22)37-4)27(34)32-23-11-8-12-24(38-18-26(31)33)21(23)17-30(32,28(35)36)16-19-9-6-5-7-10-19/h5-15H,16-18H2,1-4H3,(H2,31,33)(H,35,36)