3-(4-hydroxyphenyl)-2-[[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]amino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]amino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[(3-methyl-1,1-dioxo-thiolan-3-yl)amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[(3-methyl-1,1-dioxo-3-thiolanyl)amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[(3-methyl-1,1-dioxothiolan-3-yl)amino]propanoic acid Traditional Name: 2-[(1,1-diketo-3-methyl-thiolan-3-yl)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-14(6-7-21(19,20)9-14)15-12(13(17)18)8-10-2-4-11(16)5-3-10/h2-5,12,15-16H,6-9H2,1H3,(H,17,18)