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

Systemtic Name: (2S)-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-3-methyl-butyrate Formula: C10H11Cl2N2O3- MolecularWeight: 278.11194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1=CC(=C(N1)Cl)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)C1=CC(=C(N1)Cl)Cl

InChI

InChI=1S/C10H12Cl2N2O3/c1-4(2)7(10(16)17)14-9(15)6-3-5(11)8(12)13-6/h3-4,7,13H,1-2H3,(H,14,15)(H,16,17)/p-1/t7-/m0/s1