2-[methanoyl-(3-methyl-2-nitro-phenyl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[methanoyl-(3-methyl-2-nitro-phenyl)amino]-4-methyl-pentanoic acid Openeye Name: 2-(N-formyl-3-methyl-2-nitro-anilino)-4-methyl-pentanoic acid CAS Name: 2-(N-formyl-3-methyl-2-nitroanilino)-4-methylpentanoic acid IUPAC Name: 2-(N-formyl-3-methyl-2-nitroanilino)-4-methylpentanoic acid Traditional Name: 2-(N-formyl-3-methyl-2-nitro-anilino)-4-methyl-valeric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C=O)C(CC(C)C)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)N(C=O)C(CC(C)C)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-9(2)7-12(14(18)19)15(8-17)11-6-4-5-10(3)13(11)16(20)21/h4-6,8-9,12H,7H2,1-3H3,(H,18,19)