[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(2-furyl)methanone CAS Name: [4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazino]-(2-furyl)methanone Formula: C16H16ClN3O6S MolecularWeight: 413.83274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C16H16ClN3O6S/c1-11-13(17)9-12(10-14(11)20(22)23)27(24,25)19-6-4-18(5-7-19)16(21)15-3-2-8-26-15/h2-3,8-10H,4-7H2,1H3