[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 4-acetamidobenzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 4-acetamidobenzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [(2R)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl] 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [(1R)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H27N3O6S/c1-16(32-23(29)18-6-8-19(9-7-18)24-17(2)27)22(28)25-20-10-12-21(13-11-20)33(30,31)26-14-4-3-5-15-26/h6-13,16H,3-5,14-15H2,1-2H3,(H,24,27)(H,25,28)/t16-/m1/s1