[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-[[(E)-styryl]sulfonylamino]benzoate CAS Name: 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate Traditional Name: 4-[[(E)-styryl]sulfonylamino]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-15(20(24)22-18-11-12-18)28-21(25)17-7-9-19(10-8-17)23-29(26,27)14-13-16-5-3-2-4-6-16/h2-10,13-15,18,23H,11-12H2,1H3,(H,22,24)/b14-13+/t15-/m1/s1