(3,4-dimethylphenyl)-[4-(4-ethylpiperazin-1-yl)-6,7-dimethoxy-quinolin-3-yl]methanone

Systemtic Name: (3,4-dimethylphenyl)-[4-(4-ethylpiperazin-1-yl)-6,7-dimethoxy-quinolin-3-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[4-(4-ethylpiperazin-1-yl)-6,7-dimethoxy-3-quinolyl]methanone CAS Name: (3,4-dimethylphenyl)-[4-(4-ethyl-1-piperazinyl)-6,7-dimethoxy-3-quinolinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[4-(4-ethylpiperazin-1-yl)-6,7-dimethoxyquinolin-3-yl]methanone Traditional Name: (3,4-dimethylphenyl)-[4-(4-ethylpiperazino)-6,7-dimethoxy-3-quinolyl]methanone Formula: C26H31N3O3 MolecularWeight: 433.54264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H31N3O3/c1-6-28-9-11-29(12-10-28)25-20-14-23(31-4)24(32-5)15-22(20)27-16-21(25)26(30)19-8-7-17(2)18(3)13-19/h7-8,13-16H,6,9-12H2,1-5H3