methyl (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate CAS Name: (Z)-2-cyano-3-[9-methyl-2-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[4-keto-9-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyrido[1,2-a]pyrimidin-3-yl]acrylic acid methyl ester Formula: C19H22N5O3+ MolecularWeight: 368.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)OC)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)/C=C(/C#N)\C(=O)OC)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H21N5O3/c1-13-5-4-6-24-16(13)21-17(23-9-7-22(2)8-10-23)15(18(24)25)11-14(12-20)19(26)27-3/h4-6,11H,7-10H2,1-3H3/p+1/b14-11-