3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-(4-piperonylpiperazine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=C5C=CC=CN5C4=O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=C5C=CC=CN5C4=O

InChI

InChI=1S/C21H20N4O4/c26-20(16-12-22-19-3-1-2-6-25(19)21(16)27)24-9-7-23(8-10-24)13-15-4-5-17-18(11-15)29-14-28-17/h1-6,11-12H,7-10,13-14H2