4-[(3-phenyl-2-phosphonooxy-propanoyl)amino]benzoic acid

Systemtic Name: 4-[(3-phenyl-2-phosphonooxy-propanoyl)amino]benzoic acid Openeye Name: 4-[(3-phenyl-2-phosphonooxy-propanoyl)amino]benzoic acid CAS Name: 4-[(1-oxo-3-phenyl-2-phosphonooxypropyl)amino]benzoic acid IUPAC Name: 4-[(3-phenyl-2-phosphonooxypropanoyl)amino]benzoic acid Traditional Name: 4-[(3-phenyl-2-phosphonooxy-propanoyl)amino]benzoic acid Formula: C16H16NO7P MolecularWeight: 365.274501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)C(=O)O)OP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)C(=O)O)OP(=O)(O)O

InChI

InChI=1S/C16H16NO7P/c18-15(17-13-8-6-12(7-9-13)16(19)20)14(24-25(21,22)23)10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H,17,18)(H,19,20)(H2,21,22,23)