1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-one

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-one Openeye Name: 1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-one CAS Name: 1-(2-methoxy-5-nitrophenyl)sulfonyl-4-piperidinone IUPAC Name: 1-(2-methoxy-5-nitrophenyl)sulfonylpiperidin-4-one Traditional Name: 1-(2-methoxy-5-nitro-phenyl)sulfonyl-4-piperidone Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(=O)CC2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(=O)CC2

InChI

InChI=1S/C12H14N2O6S/c1-20-11-3-2-9(14(16)17)8-12(11)21(18,19)13-6-4-10(15)5-7-13/h2-3,8H,4-7H2,1H3