N-[4-(2-tert-butylphenyl)carbonylcyclohexa-1,5-dien-1-yl]-2-quinolin-4-yl-propanamide

Systemtic Name: N-[4-(2-tert-butylphenyl)carbonylcyclohexa-1,5-dien-1-yl]-2-quinolin-4-yl-propanamide Openeye Name: N-[4-(2-tert-butylbenzoyl)cyclohexa-1,5-dien-1-yl]-2-(4-quinolyl)propanamide CAS Name: N-[4-[(2-tert-butylphenyl)-oxomethyl]-1-cyclohexa-1,5-dienyl]-2-(4-quinolinyl)propanamide IUPAC Name: N-[4-(2-tert-butylbenzoyl)cyclohexa-1,5-dien-1-yl]-2-quinolin-4-ylpropanamide Traditional Name: N-[4-(2-tert-butylbenzoyl)cyclohexa-1,5-dien-1-yl]-2-(4-quinolyl)propionamide Formula: C29H30N2O2 MolecularWeight: 438.5607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC2=CC=CC=C12)C(=O)NC3=CCC(C=C3)C(=O)C4=CC=CC=C4C(C)(C)C

Isomeric SMILES

CC(C1=CC=NC2=CC=CC=C12)C(=O)NC3=CCC(C=C3)C(=O)C4=CC=CC=C4C(C)(C)C

InChI

InChI=1S/C29H30N2O2/c1-19(22-17-18-30-26-12-8-6-9-23(22)26)28(33)31-21-15-13-20(14-16-21)27(32)24-10-5-7-11-25(24)29(2,3)4/h5-13,15-20H,14H2,1-4H3,(H,31,33)