2-[3,4-bis(oxidanyl)phenyl]-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoic acid

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoic acid Openeye Name: 2-(3,4-dihydroxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]acetic acid CAS Name: 2-(3,4-dihydroxyphenyl)-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]acetic acid IUPAC Name: 2-(3,4-dihydroxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]acetic acid Traditional Name: 2-(3,4-dihydroxyphenyl)-2-[(4-nitrobenzyl)oxycarbonylamino]acetic acid Formula: C16H14N2O8 MolecularWeight: 362.29096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)NC(C2=CC(=C(C=C2)O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)NC(C2=CC(=C(C=C2)O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O8/c19-12-6-3-10(7-13(12)20)14(15(21)22)17-16(23)26-8-9-1-4-11(5-2-9)18(24)25/h1-7,14,19-20H,8H2,(H,17,23)(H,21,22)