2-[methoxycarbonyl-[2-(5-nitropyridin-2-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[methoxycarbonyl-[2-(5-nitropyridin-2-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[methoxycarbonyl-[2-(5-nitro-2-pyridyl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[methoxycarbonyl-[2-(5-nitro-2-pyridinyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[methoxycarbonyl-[2-(5-nitropyridin-2-yl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carbomethoxy-[2-(5-nitro-2-pyridyl)ethyl]amino]-4-methyl-valeric acid Formula: C15H21N3O6 MolecularWeight: 339.34374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=NC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=NC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H21N3O6/c1-10(2)8-13(14(19)20)17(15(21)24-3)7-6-11-4-5-12(9-16-11)18(22)23/h4-5,9-10,13H,6-8H2,1-3H3,(H,19,20)