4-[2-[3,5-bis(chloranyl)-2-[[(3-chlorophenyl)-methyl-amino]methyl]-6-oxidanylidene-pyridin-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3,5-bis(chloranyl)-2-[[(3-chlorophenyl)-methyl-amino]methyl]-6-oxidanylidene-pyridin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[3,5-dichloro-2-[(3-chloro-N-methyl-anilino)methyl]-6-oxo-1-pyridyl]ethyl]benzoic acid CAS Name: 4-[2-[3,5-dichloro-2-[(3-chloro-N-methylanilino)methyl]-6-oxo-1-pyridinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[3,5-dichloro-2-[(3-chloro-N-methylanilino)methyl]-6-oxopyridin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[3,5-dichloro-2-[(3-chloro-N-methyl-anilino)methyl]-6-keto-1-pyridyl]ethyl]benzoic acid Formula: C22H19Cl3N2O3 MolecularWeight: 465.75686

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C(=O)N1CCC2=CC=C(C=C2)C(=O)O)Cl)Cl)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN(CC1=C(C=C(C(=O)N1CCC2=CC=C(C=C2)C(=O)O)Cl)Cl)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H19Cl3N2O3/c1-26(17-4-2-3-16(23)11-17)13-20-18(24)12-19(25)21(28)27(20)10-9-14-5-7-15(8-6-14)22(29)30/h2-8,11-12H,9-10,13H2,1H3,(H,29,30)