1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]chromeno[4,3-c]pyrazol-4-one

Systemtic Name: 1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]chromeno[4,3-c]pyrazol-4-one Openeye Name: 1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]chromeno[4,3-c]pyrazol-4-one CAS Name: 1-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-4-[1]benzopyrano[4,3-c]pyrazolone IUPAC Name: 1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]chromeno[4,3-c]pyrazol-4-one Traditional Name: 1-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]chromeno[4,3-c]pyrazol-4-one Formula: C17H19N4O3+ MolecularWeight: 327.35776

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C3=C(C=N2)C(=O)OC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C3=C(C=N2)C(=O)OC4=CC=CC=C43

InChI

InChI=1S/C17H18N4O3/c1-19-6-8-20(9-7-19)15(22)11-21-16-12-4-2-3-5-14(12)24-17(23)13(16)10-18-21/h2-5,10H,6-9,11H2,1H3/p+1