1-methyl-3-(piperazine-1,4-diium-1-ylmethyl)quinolin-2-one

Systemtic Name: 1-methyl-3-(piperazine-1,4-diium-1-ylmethyl)quinolin-2-one Openeye Name: 1-methyl-3-(piperazine-1,4-diium-1-ylmethyl)quinolin-2-one CAS Name: 1-methyl-3-(1-piperazine-1,4-diiumylmethyl)-2-quinolinone IUPAC Name: 1-methyl-3-(piperazine-1,4-diium-1-ylmethyl)quinolin-2-one Traditional Name: 1-methyl-3-(piperazine-1,4-diium-1-ylmethyl)carbostyril Formula: C15H21N3O+2 MolecularWeight: 259.34674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C(C1=O)C[NH+]3CC[NH2+]CC3

Isomeric SMILES

CN1C2=CC=CC=C2C=C(C1=O)C[NH+]3CC[NH2+]CC3

InChI

InChI=1S/C15H19N3O/c1-17-14-5-3-2-4-12(14)10-13(15(17)19)11-18-8-6-16-7-9-18/h2-5,10,16H,6-9,11H2,1H3/p+2