ethyl 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(oxidanylamino)-3-oxidanylidene-propyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(oxidanylamino)-3-oxidanylidene-propyl]cyclohexane-1-carboxylate Openeye Name: ethyl 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(hydroxyamino)-3-oxo-propyl]cyclohexanecarboxylate CAS Name: 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(hydroxyamino)-3-oxopropyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(hydroxyamino)-3-oxopropyl]cyclohexane-1-carboxylate Traditional Name: 3-[1-(3,4-dimethoxyphenyl)sulfonyl-3-(hydroxyamino)-3-keto-propyl]cyclohexanecarboxylic acid ethyl ester Formula: C20H29NO8S MolecularWeight: 443.51116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H29NO8S/c1-4-29-20(23)14-7-5-6-13(10-14)18(12-19(22)21-24)30(25,26)15-8-9-16(27-2)17(11-15)28-3/h8-9,11,13-14,18,24H,4-7,10,12H2,1-3H3,(H,21,22)