4-(cyclohexylamino)-2-methyl-5-nitro-benzoic acid

Systemtic Name: 4-(cyclohexylamino)-2-methyl-5-nitro-benzoic acid Openeye Name: 4-(cyclohexylamino)-2-methyl-5-nitro-benzoic acid CAS Name: 4-(cyclohexylamino)-2-methyl-5-nitrobenzoic acid IUPAC Name: 4-(cyclohexylamino)-2-methyl-5-nitrobenzoic acid Traditional Name: 4-(cyclohexylamino)-2-methyl-5-nitro-benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])NC2CCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])NC2CCCCC2

InChI

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