propyl 2-[4-(4-methylpiperazin-4-ium-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate

Systemtic Name: propyl 2-[4-(4-methylpiperazin-4-ium-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: propyl 2-[4-(4-methylpiperazin-4-ium-1-yl)-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[4-(4-methyl-1-piperazin-4-iumyl)-6-oxo-1-pyridazinyl]acetic acid propyl ester IUPAC Name: propyl 2-[4-(4-methylpiperazin-4-ium-1-yl)-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[6-keto-4-(4-methylpiperazin-4-ium-1-yl)pyridazin-1-yl]acetic acid propyl ester Formula: C14H23N4O3+ MolecularWeight: 295.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C

Isomeric SMILES

CCCOC(=O)CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C

InChI

InChI=1S/C14H22N4O3/c1-3-8-21-14(20)11-18-13(19)9-12(10-15-18)17-6-4-16(2)5-7-17/h9-10H,3-8,11H2,1-2H3/p+1