6-(dimethylamino)-2-methyl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 6-(dimethylamino)-2-methyl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-6-(dimethylamino)-2-methyl-1H-quinolin-4-one CAS Name: 6-(dimethylamino)-2-methyl-3-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-1H-quinolin-4-one IUPAC Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-6-(dimethylamino)-2-methyl-1H-quinolin-4-one Traditional Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-6-(dimethylamino)-2-methyl-4-quinolone Formula: C24H32N4O+2 MolecularWeight: 392.53708

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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+]3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H30N4O/c1-18-22(24(29)21-15-20(26(2)3)9-10-23(21)25-18)17-28-13-11-27(12-14-28)16-19-7-5-4-6-8-19/h4-10,15H,11-14,16-17H2,1-3H3,(H,25,29)/p+2