2-[(5-bromanylthiophen-3-yl)carbonylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[(5-bromanylthiophen-3-yl)carbonylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[(5-bromothiophene-3-carbonyl)amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[(5-bromo-3-thiophenyl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[(5-bromothiophene-3-carbonyl)amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[(5-bromothiophene-3-carbonyl)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C14H12BrNO4S MolecularWeight: 370.21838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CSC(=C2)Br)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CSC(=C2)Br)O

InChI

InChI=1S/C14H12BrNO4S/c15-12-6-9(7-21-12)13(18)16-11(14(19)20)5-8-1-3-10(17)4-2-8/h1-4,6-7,11,17H,5H2,(H,16,18)(H,19,20)