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

Systemtic Name: 3-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 3-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: 3-[[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: 3-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propionic acid Formula: C14H12Cl2N2O3 MolecularWeight: 327.16268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=C(N2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=C(N2)Cl)Cl

InChI

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