4-[3-oxidanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]benzoic acid

Systemtic Name: 4-[3-oxidanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]benzoic acid Openeye Name: 4-[2-(benzyloxycarbonylamino)-3-hydroxy-3-oxo-propyl]benzoic acid CAS Name: 4-[3-hydroxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]benzoic acid IUPAC Name: 4-[3-hydroxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]benzoic acid Traditional Name: 4-[2-(benzyloxycarbonylamino)-3-hydroxy-3-keto-propyl]benzoic acid Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C18H17NO6/c20-16(21)14-8-6-12(7-9-14)10-15(17(22)23)19-18(24)25-11-13-4-2-1-3-5-13/h1-9,15H,10-11H2,(H,19,24)(H,20,21)(H,22,23)