3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid; 2-(thiophen-2-ylamino)propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid; 2-(thiophen-2-ylamino)propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid; 2-(2-thienylamino)propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid; 2-(thiophen-2-ylamino)propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid; 2-(thiophen-2-ylamino)propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-(methylamino)propionic acid; 2-(2-thienylamino)propionic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC=CS1.CNC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CC(C(=O)O)NC1=CC=CS1.CNC(CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C10H13NO3.C7H9NO2S/c1-11-9(10(13)14)6-7-2-4-8(12)5-3-7;1-5(7(9)10)8-6-3-2-4-11-6/h2-5,9,11-12H,6H2,1H3,(H,13,14);2-5,8H,1H3,(H,9,10)