4-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-1H-quinolin-2-one

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-1H-quinolin-2-one Openeye Name: 4-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-1H-quinolin-2-one CAS Name: 4-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-1H-quinolin-2-one IUPAC Name: 4-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-1H-quinolin-2-one Traditional Name: 4-(4-piperonyloylpiperazino)carbostyril Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=O)NC3=CC=CC=C32)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=CC(=O)NC3=CC=CC=C32)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O4/c25-20-12-17(15-3-1-2-4-16(15)22-20)23-7-9-24(10-8-23)21(26)14-5-6-18-19(11-14)28-13-27-18/h1-6,11-12H,7-10,13H2,(H,22,25)