2-[[[[(2-chlorophenyl)amino]-phenyl-methyl]-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[[[(2-chlorophenyl)amino]-phenyl-methyl]-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[[(2-chloroanilino)-phenyl-methyl]-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[[(2-chloroanilino)-phenylmethyl]-hydroxyphosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[[(2-chloroanilino)-phenylmethyl]-hydroxyphosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[[(2-chloroanilino)-phenyl-methyl]-hydroxy-phosphoryl]methyl]glutaric acid Formula: C19H21ClNO6P MolecularWeight: 425.799901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NC2=CC=CC=C2Cl)P(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NC2=CC=CC=C2Cl)P(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C19H21ClNO6P/c20-15-8-4-5-9-16(15)21-18(13-6-2-1-3-7-13)28(26,27)12-14(19(24)25)10-11-17(22)23/h1-9,14,18,21H,10-12H2,(H,22,23)(H,24,25)(H,26,27)