2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid

Systemtic Name: 2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid Openeye Name: 2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid CAS Name: 2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid IUPAC Name: 2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid Traditional Name: 2-[[dipropoxyphosphoryl(phenyl)methyl]amino]benzoic acid Formula: C20H26NO5P MolecularWeight: 391.397901

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(C(C1=CC=CC=C1)NC2=CC=CC=C2C(=O)O)OCCC

Isomeric SMILES

CCCOP(=O)(C(C1=CC=CC=C1)NC2=CC=CC=C2C(=O)O)OCCC

InChI

InChI=1S/C20H26NO5P/c1-3-14-25-27(24,26-15-4-2)19(16-10-6-5-7-11-16)21-18-13-9-8-12-17(18)20(22)23/h5-13,19,21H,3-4,14-15H2,1-2H3,(H,22,23)