6-acetamido-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(phenylmethyl)-3,4-dihydroquinoline-2-carboxylic acid

Systemtic Name: 6-acetamido-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(phenylmethyl)-3,4-dihydroquinoline-2-carboxylic acid Openeye Name: 6-acetamido-2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-3,4-dihydroquinoline-2-carboxylic acid CAS Name: 6-acetamido-1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-2-(phenylmethyl)-3,4-dihydroquinoline-2-carboxylic acid IUPAC Name: 6-acetamido-2-benzyl-1-(4-tert-butyl-3-methoxybenzoyl)-3,4-dihydroquinoline-2-carboxylic acid Traditional Name: 6-acetamido-2-benzyl-1-(4-tert-butyl-3-methoxy-benzoyl)-3,4-dihydroquinoline-2-carboxylic acid Formula: C31H34N2O5 MolecularWeight: 514.61206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(CC2)(CC3=CC=CC=C3)C(=O)O)C(=O)C4=CC(=C(C=C4)C(C)(C)C)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(CC2)(CC3=CC=CC=C3)C(=O)O)C(=O)C4=CC(=C(C=C4)C(C)(C)C)OC

InChI

InChI=1S/C31H34N2O5/c1-20(34)32-24-12-14-26-22(17-24)15-16-31(29(36)37,19-21-9-7-6-8-10-21)33(26)28(35)23-11-13-25(30(2,3)4)27(18-23)38-5/h6-14,17-18H,15-16,19H2,1-5H3,(H,32,34)(H,36,37)