[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl] 2-(methylamino)benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl] 2-(methylamino)benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-(methylamino)benzoate CAS Name: 2-(methylamino)benzoic acid [(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl] 2-(methylamino)benzoate Traditional Name: 2-(methylamino)benzoic acid [(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl] ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC(=O)C3=CC=CC=C3NC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC(=O)C3=CC=CC=C3NC

InChI

InChI=1S/C21H25N3O5S/c1-15(29-21(26)18-7-3-4-8-19(18)22-2)20(25)23-16-9-11-17(12-10-16)30(27,28)24-13-5-6-14-24/h3-4,7-12,15,22H,5-6,13-14H2,1-2H3,(H,23,25)/t15-/m1/s1