2-[[[(2-carboxylatophenyl)amino]methyl-phenyl-phosphanyl]methylamino]benzoate

Systemtic Name: 2-[[[(2-carboxylatophenyl)amino]methyl-phenyl-phosphanyl]methylamino]benzoate Openeye Name: 2-[[(2-carboxylatoanilino)methyl-phenyl-phosphanyl]methylamino]benzoate CAS Name: 2-[[(2-carboxylatoanilino)methyl-phenylphosphino]methylamino]benzoate IUPAC Name: 2-[[(2-carboxylatoanilino)methyl-phenylphosphanyl]methylamino]benzoate Traditional Name: 2-[[(2-carboxylatoanilino)methyl-phenyl-phosphino]methylamino]benzoate Formula: C22H19N2O4P-2 MolecularWeight: 406.371021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(CNC2=CC=CC=C2C(=O)[O-])CNC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)P(CNC2=CC=CC=C2C(=O)[O-])CNC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C22H21N2O4P/c25-21(26)17-10-4-6-12-19(17)23-14-29(16-8-2-1-3-9-16)15-24-20-13-7-5-11-18(20)22(27)28/h1-13,23-24H,14-15H2,(H,25,26)(H,27,28)/p-2