6-chloranyl-2-[(4-methylphenyl)amino]-3-nitro-benzoic acid

Systemtic Name: 6-chloranyl-2-[(4-methylphenyl)amino]-3-nitro-benzoic acid Openeye Name: 6-chloro-2-(4-methylanilino)-3-nitro-benzoic acid CAS Name: 6-chloro-2-(4-methylanilino)-3-nitrobenzoic acid IUPAC Name: 6-chloro-2-(4-methylanilino)-3-nitrobenzoic acid Traditional Name: 6-chloro-3-nitro-2-(p-toluidino)benzoic acid Formula: C14H11ClN2O4 MolecularWeight: 306.70114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN2O4/c1-8-2-4-9(5-3-8)16-13-11(17(20)21)7-6-10(15)12(13)14(18)19/h2-7,16H,1H3,(H,18,19)