3-(3-ethanoyl-4-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(3-ethanoyl-4-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(3-acetyl-4-hydroxy-phenyl)-2-(benzyloxycarbonylamino)propanoic acid CAS Name: 3-(3-acetyl-4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(3-acetyl-4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-(3-acetyl-4-hydroxy-phenyl)-2-(benzyloxycarbonylamino)propionic acid Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C19H19NO6/c1-12(21)15-9-14(7-8-17(15)22)10-16(18(23)24)20-19(25)26-11-13-5-3-2-4-6-13/h2-9,16,22H,10-11H2,1H3,(H,20,25)(H,23,24)