methyl 2-(2-oxidanylidene-4-quinolin-3-ylcarbonyl-piperazin-1-yl)ethanoate

Systemtic Name: methyl 2-(2-oxidanylidene-4-quinolin-3-ylcarbonyl-piperazin-1-yl)ethanoate Openeye Name: methyl 2-[2-oxo-4-(quinoline-3-carbonyl)piperazin-1-yl]acetate CAS Name: 2-[2-oxo-4-[oxo(3-quinolinyl)methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-oxo-4-(quinoline-3-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-[2-keto-4-(quinoline-3-carbonyl)piperazino]acetic acid methyl ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(CC1=O)C(=O)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

COC(=O)CN1CCN(CC1=O)C(=O)C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C17H17N3O4/c1-24-16(22)11-19-6-7-20(10-15(19)21)17(23)13-8-12-4-2-3-5-14(12)18-9-13/h2-5,8-9H,6-7,10-11H2,1H3