methyl 2-[(4-bromanyl-1-propan-2-yl-pyrrol-2-yl)carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-bromanyl-1-propan-2-yl-pyrrol-2-yl)carbonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-bromo-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-1-propan-2-ylpyrrole-2-carbonyl)amino]-3-methylbutanoate Traditional Name: 2-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]-3-methyl-butyric acid methyl ester Formula: C14H21BrN2O3 MolecularWeight: 345.23214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CC(=CN1C(C)C)Br

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)C1=CC(=CN1C(C)C)Br

InChI

InChI=1S/C14H21BrN2O3/c1-8(2)12(14(19)20-5)16-13(18)11-6-10(15)7-17(11)9(3)4/h6-9,12H,1-5H3,(H,16,18)