3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1,2-dimethyl-quinolin-4-one

Systemtic Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1,2-dimethyl-quinolin-4-one Openeye Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1,2-dimethyl-quinolin-4-one CAS Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-1,2-dimethyl-4-quinolinone IUPAC Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1,2-dimethylquinolin-4-one Traditional Name: 1,2-dimethyl-3-[(4-piperonylpiperazino)methyl]-4-quinolone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2N1C)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2N1C)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O3/c1-17-20(24(28)19-5-3-4-6-21(19)25(17)2)15-27-11-9-26(10-12-27)14-18-7-8-22-23(13-18)30-16-29-22/h3-8,13H,9-12,14-16H2,1-2H3