[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-[[(E)-styryl]sulfonylamino]propanoate CAS Name: 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Traditional Name: 3-[[(E)-styryl]sulfonylamino]propionic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)CCNS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5S/c1-3-17-16(20)13(2)23-15(19)9-11-18-24(21,22)12-10-14-7-5-4-6-8-14/h4-8,10,12-13,18H,3,9,11H2,1-2H3,(H,17,20)/b12-10+/t13-/m0/s1