2-[[4-[2-(2-chlorophenyl)ethyl]phenyl]amino]-5-nitro-benzoic acid

Systemtic Name: 2-[[4-[2-(2-chlorophenyl)ethyl]phenyl]amino]-5-nitro-benzoic acid Openeye Name: 2-[4-[2-(2-chlorophenyl)ethyl]anilino]-5-nitro-benzoic acid CAS Name: 2-[4-[2-(2-chlorophenyl)ethyl]anilino]-5-nitrobenzoic acid IUPAC Name: 2-[4-[2-(2-chlorophenyl)ethyl]anilino]-5-nitrobenzoic acid Traditional Name: 2-[4-[2-(2-chlorophenyl)ethyl]anilino]-5-nitro-benzoic acid Formula: C21H17ClN2O4 MolecularWeight: 396.82368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O)Cl

InChI

InChI=1S/C21H17ClN2O4/c22-19-4-2-1-3-15(19)8-5-14-6-9-16(10-7-14)23-20-12-11-17(24(27)28)13-18(20)21(25)26/h1-4,6-7,9-13,23H,5,8H2,(H,25,26)