3-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]pyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]pyrido[4,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]pyrido[4,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-methyl-1-piperazin-4-iumyl)ethyl]-4-pyrido[4,3-d]pyrimidinone IUPAC Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]pyrido[4,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]pyrido[4,3-d]pyrimidin-4-one Formula: C14H20N5O+ MolecularWeight: 274.3415

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCN2C=NC3=C(C2=O)C=NC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)CCN2C=NC3=C(C2=O)C=NC=C3

InChI

InChI=1S/C14H19N5O/c1-17-4-6-18(7-5-17)8-9-19-11-16-13-2-3-15-10-12(13)14(19)20/h2-3,10-11H,4-9H2,1H3/p+1