4-methyl-2-[(5-nitrothiophen-2-yl)carbonylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[(5-nitrothiophen-2-yl)carbonylamino]pentanoic acid Openeye Name: 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]pentanoic acid CAS Name: 4-methyl-2-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]pentanoic acid Traditional Name: 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]valeric acid Formula: C11H14N2O5S MolecularWeight: 286.30426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1=CC=C(S1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1=CC=C(S1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O5S/c1-6(2)5-7(11(15)16)12-10(14)8-3-4-9(19-8)13(17)18/h3-4,6-7H,5H2,1-2H3,(H,12,14)(H,15,16)