(3,3-dimethyl-2-oxidanylidene-butyl) (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (2S)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanoate CAS Name: (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-[[(E)-styryl]sulfonylamino]butyric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C(C)(C)C)NS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C(C)(C)C)NS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C19H27NO5S/c1-14(2)17(18(22)25-13-16(21)19(3,4)5)20-26(23,24)12-11-15-9-7-6-8-10-15/h6-12,14,17,20H,13H2,1-5H3/b12-11+/t17-/m0/s1