methyl 2-[(4-bromanyl-1-cyclopropyl-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-bromanyl-1-cyclopropyl-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[(4-bromo-1-cyclopropyl-pyrrole-2-carbonyl)amino]-3-hydroxy-propanoate CAS Name: 2-[[(4-bromo-1-cyclopropyl-2-pyrrolyl)-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-1-cyclopropylpyrrole-2-carbonyl)amino]-3-hydroxypropanoate Traditional Name: 2-[(4-bromo-1-cyclopropyl-pyrrole-2-carbonyl)amino]-3-hydroxy-propionic acid methyl ester Formula: C12H15BrN2O4 MolecularWeight: 331.1625

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC(=CN1C2CC2)Br

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC(=CN1C2CC2)Br

InChI

InChI=1S/C12H15BrN2O4/c1-19-12(18)9(6-16)14-11(17)10-4-7(13)5-15(10)8-2-3-8/h4-5,8-9,16H,2-3,6H2,1H3,(H,14,17)