[2-[(4-methoxyphenyl)carbamoylamino]-2-oxidanylidene-ethyl] (2S)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: [2-[(4-methoxyphenyl)carbamoylamino]-2-oxidanylidene-ethyl] (2S)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: [2-[(4-methoxyphenyl)carbamoylamino]-2-oxo-ethyl] (2S)-1-(p-tolylsulfonyl)piperidine-2-carboxylate CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid [2-[[(4-methoxyanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methoxyphenyl)carbamoylamino]-2-oxoethyl] (2S)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2S)-1-tosylpipecolinic acid [2-keto-2-[(4-methoxyphenyl)carbamoylamino]ethyl] ester Formula: C23H27N3O7S MolecularWeight: 489.54138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCC(=O)NC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H27N3O7S/c1-16-6-12-19(13-7-16)34(30,31)26-14-4-3-5-20(26)22(28)33-15-21(27)25-23(29)24-17-8-10-18(32-2)11-9-17/h6-13,20H,3-5,14-15H2,1-2H3,(H2,24,25,27,29)/t20-/m0/s1