4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]benzo[h]chromen-2-one

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]benzo[h]chromen-2-one Openeye Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]benzo[h]chromen-2-one CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-2-benzo[h][1]benzopyranone IUPAC Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]benzo[h]chromen-2-one Traditional Name: 4-[(4-piperonylpiperazino)methyl]benzo[h]chromen-2-one Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC(=O)OC5=C4C=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC(=O)OC5=C4C=CC6=CC=CC=C65

InChI

InChI=1S/C26H24N2O4/c29-25-14-20(22-7-6-19-3-1-2-4-21(19)26(22)32-25)16-28-11-9-27(10-12-28)15-18-5-8-23-24(13-18)31-17-30-23/h1-8,13-14H,9-12,15-17H2