methyl 2-[2-oxidanylidene-4-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)carbonyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[2-oxidanylidene-4-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)carbonyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-[2-oxo-4-(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)piperazin-1-yl]acetate CAS Name: 2-[2-oxo-4-[oxo-(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-oxo-4-(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-[2-keto-4-(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)piperazino]acetic acid methyl ester Formula: C16H17N4O5+ MolecularWeight: 345.32998

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(CC1=O)C(=O)C2=CNC3=CC=CC=[N+]3C2=O

Isomeric SMILES

COC(=O)CN1CCN(CC1=O)C(=O)C2=CNC3=CC=CC=[N+]3C2=O

InChI

InChI=1S/C16H16N4O5/c1-25-14(22)10-18-6-7-19(9-13(18)21)15(23)11-8-17-12-4-2-3-5-20(12)16(11)24/h2-5,8H,6-7,9-10H2,1H3/p+1