1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxamide CAS Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylisonipecotamide Formula: C13H16ClN3O5S MolecularWeight: 361.80124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3O5S/c1-8-11(14)6-10(7-12(8)17(19)20)23(21,22)16-4-2-9(3-5-16)13(15)18/h6-7,9H,2-5H2,1H3,(H2,15,18)