methyl 2-benzamido-3-dimethoxyphosphoryl-3-[2,4,6-tris(oxidanyl)phenyl]propanoate

Systemtic Name: methyl 2-benzamido-3-dimethoxyphosphoryl-3-[2,4,6-tris(oxidanyl)phenyl]propanoate Openeye Name: methyl 2-benzamido-3-dimethoxyphosphoryl-3-(2,4,6-trihydroxyphenyl)propanoate CAS Name: 2-benzamido-3-dimethoxyphosphoryl-3-(2,4,6-trihydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-dimethoxyphosphoryl-3-(2,4,6-trihydroxyphenyl)propanoate Traditional Name: 2-benzamido-3-dimethoxyphosphoryl-3-(2,4,6-trihydroxyphenyl)propionic acid methyl ester Formula: C19H22NO9P MolecularWeight: 439.353041

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=C(C=C(C=C1O)O)O)P(=O)(OC)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C(C1=C(C=C(C=C1O)O)O)P(=O)(OC)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22NO9P/c1-27-19(25)16(20-18(24)11-7-5-4-6-8-11)17(30(26,28-2)29-3)15-13(22)9-12(21)10-14(15)23/h4-10,16-17,21-23H,1-3H3,(H,20,24)