6-[methanoyl-(3-methyl-4-nitro-phenyl)amino]hexanoic acid

Systemtic Name: 6-[methanoyl-(3-methyl-4-nitro-phenyl)amino]hexanoic acid Openeye Name: 6-(N-formyl-3-methyl-4-nitro-anilino)hexanoic acid CAS Name: 6-(N-formyl-3-methyl-4-nitroanilino)hexanoic acid IUPAC Name: 6-(N-formyl-3-methyl-4-nitroanilino)hexanoic acid Traditional Name: 6-(N-formyl-3-methyl-4-nitro-anilino)hexanoic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-11-9-12(6-7-13(11)16(20)21)15(10-17)8-4-2-3-5-14(18)19/h6-7,9-10H,2-5,8H2,1H3,(H,18,19)