(2S)-2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]-2-phenylacetate Traditional Name: (2S)-2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-2-phenyl-acetate Formula: C14H12BrN2O3- MolecularWeight: 336.16068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC(C2=CC=CC=C2)C(=O)[O-])Br

Isomeric SMILES

CN1C=C(C=C1C(=O)N[C@@H](C2=CC=CC=C2)C(=O)[O-])Br

InChI

InChI=1S/C14H13BrN2O3/c1-17-8-10(15)7-11(17)13(18)16-12(14(19)20)9-5-3-2-4-6-9/h2-8,12H,1H3,(H,16,18)(H,19,20)/p-1/t12-/m0/s1