6-ethyl-2-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]-1H-quinolin-4-one

Systemtic Name: 6-ethyl-2-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]-1H-quinolin-4-one Openeye Name: 6-ethyl-2-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]-1H-quinolin-4-one CAS Name: 6-ethyl-2-methyl-3-[(4-methyl-1-piperazin-4-iumyl)methyl]-1H-quinolin-4-one IUPAC Name: 6-ethyl-2-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]-1H-quinolin-4-one Traditional Name: 6-ethyl-2-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]-4-quinolone Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=C(C2=O)CN3CC[NH+](CC3)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=C(C2=O)CN3CC[NH+](CC3)C)C

InChI

InChI=1S/C18H25N3O/c1-4-14-5-6-17-15(11-14)18(22)16(13(2)19-17)12-21-9-7-20(3)8-10-21/h5-6,11H,4,7-10,12H2,1-3H3,(H,19,22)/p+1