[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (2-oxo-2-ureido-ethyl) 1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxylic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-methoxyphenyl)sulfonylnipecotic acid (2-keto-2-ureido-ethyl) ester Formula: C16H21N3O7S MolecularWeight: 399.41884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)OCC(=O)NC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C16H21N3O7S/c1-25-12-4-6-13(7-5-12)27(23,24)19-8-2-3-11(9-19)15(21)26-10-14(20)18-16(17)22/h4-7,11H,2-3,8-10H2,1H3,(H3,17,18,20,22)