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

Systemtic Name: 4-aminocarbonyl-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(phenylmethyl)-3H-indole-2-carboxylic acid Openeye Name: 2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-4-carbamoyl-indoline-2-carboxylic acid CAS Name: 1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-4-carbamoyl-2-(phenylmethyl)-3H-indole-2-carboxylic acid IUPAC Name: 2-benzyl-1-(4-tert-butyl-3-methoxybenzoyl)-4-carbamoyl-3H-indole-2-carboxylic acid Traditional Name: 2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-4-carbamoyl-indoline-2-carboxylic acid Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C3=CC=CC(=C3CC2(CC4=CC=CC=C4)C(=O)O)C(=O)N)OC

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C3=CC=CC(=C3CC2(CC4=CC=CC=C4)C(=O)O)C(=O)N)OC

InChI

InChI=1S/C29H30N2O5/c1-28(2,3)22-14-13-19(15-24(22)36-4)26(33)31-23-12-8-11-20(25(30)32)21(23)17-29(31,27(34)35)16-18-9-6-5-7-10-18/h5-15H,16-17H2,1-4H3,(H2,30,32)(H,34,35)