1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidin-4-one

Systemtic Name: 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidin-4-one Openeye Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperidin-4-one CAS Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-4-piperidinone IUPAC Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperidin-4-one Traditional Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-4-piperidone Formula: C12H13ClN2O5S MolecularWeight: 332.76002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCC(=O)CC2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCC(=O)CC2)Cl

InChI

InChI=1S/C12H13ClN2O5S/c1-8-11(13)6-10(7-12(8)15(17)18)21(19,20)14-4-2-9(16)3-5-14/h6-7H,2-5H2,1H3