5-azanyl-2-[(4-bromanyl-1-ethyl-pyrrol-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(4-bromanyl-1-ethyl-pyrrol-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4-bromo-1-ethyl-pyrrole-2-carbonyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[(4-bromo-1-ethyl-2-pyrrolyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(4-bromo-1-ethylpyrrole-2-carbonyl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(4-bromo-1-ethyl-pyrrole-2-carbonyl)amino]-5-keto-valeric acid Formula: C12H16BrN3O4 MolecularWeight: 346.17714

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)NC(CCC(=O)N)C(=O)O)Br

Isomeric SMILES

CCN1C=C(C=C1C(=O)NC(CCC(=O)N)C(=O)O)Br

InChI

InChI=1S/C12H16BrN3O4/c1-2-16-6-7(13)5-9(16)11(18)15-8(12(19)20)3-4-10(14)17/h5-6,8H,2-4H2,1H3,(H2,14,17)(H,15,18)(H,19,20)