4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxidanylidene-butanamide Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-methyl-2-(4-methyl-1-piperidyl)-6-quinolyl]-4-oxo-butanamide CAS Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[4-methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]-4-oxobutanamide IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide Traditional Name: 4-keto-N-[4-methyl-2-(4-methylpiperidino)-6-quinolyl]-4-(4-piperonylpiperazino)butyramide Formula: C32H39N5O4 MolecularWeight: 557.68316

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C(=C2)C

Isomeric SMILES

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C(=C2)C

InChI

InChI=1S/C32H39N5O4/c1-22-9-11-36(12-10-22)30-17-23(2)26-19-25(4-5-27(26)34-30)33-31(38)7-8-32(39)37-15-13-35(14-16-37)20-24-3-6-28-29(18-24)41-21-40-28/h3-6,17-19,22H,7-16,20-21H2,1-2H3,(H,33,38)