5-azanyl-2-[2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-(5-bromo-2-oxo-1-pyridyl)acetyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-(5-bromo-2-oxo-1-pyridinyl)-1-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-(5-bromo-2-oxopyridin-1-yl)acetyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[2-(5-bromo-2-keto-1-pyridyl)acetyl]amino]-5-keto-valeric acid Formula: C12H14BrN3O5 MolecularWeight: 360.16066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1Br)CC(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=O)N(C=C1Br)CC(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C12H14BrN3O5/c13-7-1-4-11(19)16(5-7)6-10(18)15-8(12(20)21)2-3-9(14)17/h1,4-5,8H,2-3,6H2,(H2,14,17)(H,15,18)(H,20,21)