4-[[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one Openeye Name: 4-[[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one CAS Name: 4-[[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]methyl]-6-ethoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl]-6-ethoxychromen-2-one Traditional Name: 6-ethoxy-4-[(4-piperonyloylpiperazino)methyl]coumarin Formula: C24H24N2O6 MolecularWeight: 436.45716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H24N2O6/c1-2-29-18-4-6-20-19(13-18)17(12-23(27)32-20)14-25-7-9-26(10-8-25)24(28)16-3-5-21-22(11-16)31-15-30-21/h3-6,11-13H,2,7-10,14-15H2,1H3