5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline

Systemtic Name: 5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline Openeye Name: 5-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline CAS Name: 5-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]sulfonyl]-8-methylquinoline IUPAC Name: 5-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]sulfonyl-8-methylquinoline Traditional Name: 5-[4-(4-chloro-2-nitro-phenyl)piperazino]sulfonyl-8-methyl-quinoline Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])C=CC=N2

InChI

InChI=1S/C20H19ClN4O4S/c1-14-4-7-19(16-3-2-8-22-20(14)16)30(28,29)24-11-9-23(10-12-24)17-6-5-15(21)13-18(17)25(26)27/h2-8,13H,9-12H2,1H3