5,8-dimethoxy-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one

Systemtic Name: 5,8-dimethoxy-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one Openeye Name: 5,8-dimethoxy-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one CAS Name: 5,8-dimethoxy-2-methyl-3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-1H-quinolin-4-one IUPAC Name: 5,8-dimethoxy-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1H-quinolin-4-one Traditional Name: 5,8-dimethoxy-2-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-quinolone Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-16-18(15-25-11-13-26(14-12-25)17-7-5-4-6-8-17)23(27)21-19(28-2)9-10-20(29-3)22(21)24-16/h4-10H,11-15H2,1-3H3,(H,24,27)/p+1