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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CC=C(C=C2)Cl)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC2=CC=C(C=C2)Cl)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H17ClN2O4/c22-16-7-3-14(4-8-16)1-2-15-5-9-17(10-6-15)23-20-12-11-18(24(27)28)13-19(20)21(25)26/h3-13,23H,1-2H2,(H,25,26)