2-[2-[(4-bromanyl-1-propan-2-yl-pyrrol-2-yl)carbonylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(4-bromanyl-1-propan-2-yl-pyrrol-2-yl)carbonylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(4-bromo-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(4-bromo-1-propan-2-ylpyrrole-2-carbonyl)amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]acetyl]amino]acetic acid Formula: C12H16BrN3O4 MolecularWeight: 346.17714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)NCC(=O)NCC(=O)O)Br

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)NCC(=O)NCC(=O)O)Br

InChI

InChI=1S/C12H16BrN3O4/c1-7(2)16-6-8(13)3-9(16)12(20)15-4-10(17)14-5-11(18)19/h3,6-7H,4-5H2,1-2H3,(H,14,17)(H,15,20)(H,18,19)