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

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(1,3-benzodioxole-5-carbonyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(1,3-benzodioxole-5-carbonyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-(4-piperonyloylpiperazine-1-carbonyl)coumarin Formula: C22H18N2O6 MolecularWeight: 406.38812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C22H18N2O6/c25-20(15-5-6-18-19(12-15)29-13-28-18)23-7-9-24(10-8-23)21(26)16-11-14-3-1-2-4-17(14)30-22(16)27/h1-6,11-12H,7-10,13H2