(3S)-3-[(5-bromanylthiophen-2-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (3S)-3-[(5-bromanylthiophen-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: (3S)-3-[(5-bromothiophene-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (3S)-3-[(5-bromothiophene-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(5-bromothiophene-2-carbonyl)amino]-3-phenyl-propionate Formula: C14H11BrNO3S- MolecularWeight: 353.21104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)C2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H12BrNO3S/c15-12-7-6-11(20-12)14(19)16-10(8-13(17)18)9-4-2-1-3-5-9/h1-7,10H,8H2,(H,16,19)(H,17,18)/p-1/t10-/m0/s1