3-methyl-8-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-quinoline

Systemtic Name: 3-methyl-8-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-quinoline Openeye Name: 3-methyl-8-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-quinoline CAS Name: 3-methyl-8-[[4-(4-nitrophenyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 3-methyl-8-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylquinoline Traditional Name: 3-methyl-8-[4-(4-nitrophenyl)piperazino]sulfonyl-quinoline Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4S/c1-15-13-16-3-2-4-19(20(16)21-14-15)29(27,28)23-11-9-22(10-12-23)17-5-7-18(8-6-17)24(25)26/h2-8,13-14H,9-12H2,1H3