(2S)-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propionate Formula: C14H11Cl2N2O3- MolecularWeight: 326.15474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C2=CC(=C(N2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)C2=CC(=C(N2)Cl)Cl

InChI

InChI=1S/C14H12Cl2N2O3/c15-9-7-10(17-12(9)16)13(19)18-11(14(20)21)6-8-4-2-1-3-5-8/h1-5,7,11,17H,6H2,(H,18,19)(H,20,21)/p-1/t11-/m0/s1