5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]quinolin-1-ium

Systemtic Name: 5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]quinolin-1-ium Openeye Name: 5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]quinolin-1-ium CAS Name: 5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)-1-piperazinyl]quinolin-1-ium IUPAC Name: 5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]quinolin-1-ium Traditional Name: 5,8-dimethoxy-4-methyl-2-[4-(4-nitrophenyl)piperazino]quinolin-1-ium Formula: C22H25N4O4+ MolecularWeight: 409.4583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-15-14-20(23-22-19(30-3)9-8-18(29-2)21(15)22)25-12-10-24(11-13-25)16-4-6-17(7-5-16)26(27)28/h4-9,14H,10-13H2,1-3H3/p+1