N-[4-azanyl-2-(2,2-dimethylpropyl)quinolin-6-yl]-3-(4-chlorophenyl)propanamide

Systemtic Name: N-[4-azanyl-2-(2,2-dimethylpropyl)quinolin-6-yl]-3-(4-chlorophenyl)propanamide Openeye Name: N-[4-amino-2-(2,2-dimethylpropyl)-6-quinolyl]-3-(4-chlorophenyl)propanamide CAS Name: N-[4-amino-2-(2,2-dimethylpropyl)-6-quinolinyl]-3-(4-chlorophenyl)propanamide IUPAC Name: N-[4-amino-2-(2,2-dimethylpropyl)quinolin-6-yl]-3-(4-chlorophenyl)propanamide Traditional Name: N-(4-amino-2-neopentyl-6-quinolyl)-3-(4-chlorophenyl)propionamide Formula: C23H26ClN3O MolecularWeight: 395.92504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NC2=C(C=C(C=C2)NC(=O)CCC3=CC=C(C=C3)Cl)C(=C1)N

Isomeric SMILES

CC(C)(C)CC1=NC2=C(C=C(C=C2)NC(=O)CCC3=CC=C(C=C3)Cl)C(=C1)N

InChI

InChI=1S/C23H26ClN3O/c1-23(2,3)14-18-13-20(25)19-12-17(9-10-21(19)26-18)27-22(28)11-6-15-4-7-16(24)8-5-15/h4-5,7-10,12-13H,6,11,14H2,1-3H3,(H2,25,26)(H,27,28)