4-(cyclohexylamino)-2-methyl-3-nitro-benzoic acid

Systemtic Name: 4-(cyclohexylamino)-2-methyl-3-nitro-benzoic acid Openeye Name: 4-(cyclohexylamino)-2-methyl-3-nitro-benzoic acid CAS Name: 4-(cyclohexylamino)-2-methyl-3-nitrobenzoic acid IUPAC Name: 4-(cyclohexylamino)-2-methyl-3-nitrobenzoic acid Traditional Name: 4-(cyclohexylamino)-2-methyl-3-nitro-benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1[N+](=O)[O-])NC2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1[N+](=O)[O-])NC2CCCCC2)C(=O)O

InChI

InChI=1S/C14H18N2O4/c1-9-11(14(17)18)7-8-12(13(9)16(19)20)15-10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3,(H,17,18)