3-(3-nitrophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(3-nitrophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-3-(3-nitrophenyl)propanoic acid CAS Name: 3-(3-nitrophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(3-nitrophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-3-(3-nitrophenyl)propionic acid Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O6/c20-16(21)10-15(13-7-4-8-14(9-13)19(23)24)18-17(22)25-11-12-5-2-1-3-6-12/h1-9,15H,10-11H2,(H,18,22)(H,20,21)