7-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]carbonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]carbonyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-[4-(1,3-benzodioxole-5-carbonyl)piperazine-1-carbonyl]-4H-1,4-benzoxazin-3-one CAS Name: 7-[[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-oxomethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[4-(1,3-benzodioxole-5-carbonyl)piperazine-1-carbonyl]-4H-1,4-benzoxazin-3-one Traditional Name: 7-(4-piperonyloylpiperazine-1-carbonyl)-4H-1,4-benzoxazin-3-one Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)NC(=O)CO3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)NC(=O)CO3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O6/c25-19-11-28-17-9-13(1-3-15(17)22-19)20(26)23-5-7-24(8-6-23)21(27)14-2-4-16-18(10-14)30-12-29-16/h1-4,9-10H,5-8,11-12H2,(H,22,25)