5,8-dimethoxy-2-methyl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 5,8-dimethoxy-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]-5,8-dimethoxy-2-methyl-1H-quinolin-4-one CAS Name: 5,8-dimethoxy-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]-5,8-dimethoxy-2-methyl-1H-quinolin-4-one Traditional Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-5,8-dimethoxy-2-methyl-4-quinolone Formula: C24H31N3O3+2 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)OC)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)OC)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3/c1-17-19(24(28)22-20(29-2)9-10-21(30-3)23(22)25-17)16-27-13-11-26(12-14-27)15-18-7-5-4-6-8-18/h4-10H,11-16H2,1-3H3,(H,25,28)/p+2