4-methylsulfanyl-2-[(2-prop-2-enoxyphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(2-prop-2-enoxyphenyl)carbonylamino]butanoic acid Openeye Name: 2-[(2-allyloxybenzoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(2-prop-2-enoxyphenyl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(2-prop-2-enoxybenzoyl)amino]butanoic acid Traditional Name: 2-[(2-allyloxybenzoyl)amino]-4-(methylthio)butyric acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC=CC=C1OCC=C

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC=CC=C1OCC=C

InChI

InChI=1S/C15H19NO4S/c1-3-9-20-13-7-5-4-6-11(13)14(17)16-12(15(18)19)8-10-21-2/h3-7,12H,1,8-10H2,2H3,(H,16,17)(H,18,19)