3-(4-hydroxyphenyl)-2-(prop-2-enoxycarbonylamino)propanethioic S-acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-(prop-2-enoxycarbonylamino)propanethioic S-acid Openeye Name: 2-(allyloxycarbonylamino)-3-(4-hydroxyphenyl)propanethioic S-acid CAS Name: 3-(4-hydroxyphenyl)-2-[[oxo(prop-2-enoxy)methyl]amino]propanethioic S-acid IUPAC Name: 3-(4-hydroxyphenyl)-2-(prop-2-enoxycarbonylamino)propanethioic S-acid Traditional Name: 2-(allyloxycarbonylamino)-3-(4-hydroxyphenyl)thiopropionic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC1=CC=C(C=C1)O)C(=O)S

Isomeric SMILES

C=CCOC(=O)NC(CC1=CC=C(C=C1)O)C(=O)S

InChI

InChI=1S/C13H15NO4S/c1-2-7-18-13(17)14-11(12(16)19)8-9-3-5-10(15)6-4-9/h2-6,11,15H,1,7-8H2,(H,14,17)(H,16,19)