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

Systemtic Name: (2S)-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-methyl-valerate Formula: C11H13Cl2N2O3- MolecularWeight: 292.13852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14Cl2N2O3/c1-5(2)3-8(11(17)18)15-10(16)7-4-6(12)9(13)14-7/h4-5,8,14H,3H2,1-2H3,(H,15,16)(H,17,18)/p-1/t8-/m0/s1