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

Systemtic Name: 6-(dimethylamino)-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one Openeye Name: 6-(dimethylamino)-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one CAS Name: 6-(dimethylamino)-2-methyl-3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-1H-quinolin-4-one IUPAC Name: 6-(dimethylamino)-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one Traditional Name: 6-(dimethylamino)-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-quinolone Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O/c1-17-21(23(28)20-15-19(25(2)3)9-10-22(20)24-17)16-26-11-13-27(14-12-26)18-7-5-4-6-8-18/h4-10,15H,11-14,16H2,1-3H3,(H,24,28)/p+1