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

Systemtic Name: 3-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(1,3-benzodioxol-5-yl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(1,3-benzodioxol-5-yl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(1,3-benzodioxol-5-yl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(1,3-benzodioxol-5-yl)piperazine-1-carbonyl]coumarin Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C21H18N2O5/c24-20(16-11-14-3-1-2-4-17(14)28-21(16)25)23-9-7-22(8-10-23)15-5-6-18-19(12-15)27-13-26-18/h1-6,11-12H,7-10,13H2