2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-propoxy-1H-quinolin-4-one

Systemtic Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-propoxy-1H-quinolin-4-one Openeye Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-propoxy-1H-quinolin-4-one CAS Name: 2-methyl-3-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-6-propoxy-1H-quinolin-4-one IUPAC Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-propoxy-1H-quinolin-4-one Traditional Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-propoxy-4-quinolone Formula: C19H29N3O2+2 MolecularWeight: 331.45246

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+]3CC[NH+](CC3)C)C

Isomeric SMILES

CCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+]3CC[NH+](CC3)C)C

InChI

InChI=1S/C19H27N3O2/c1-4-11-24-15-5-6-18-16(12-15)19(23)17(14(2)20-18)13-22-9-7-21(3)8-10-22/h5-6,12H,4,7-11,13H2,1-3H3,(H,20,23)/p+2