2-(3,4-diacetyloxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoic acid

Systemtic Name: 2-(3,4-diacetyloxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoic acid Openeye Name: 2-(3,4-diacetoxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]acetic acid CAS Name: 2-(3,4-diacetyloxyphenyl)-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]acetic acid IUPAC Name: 2-(3,4-diacetyloxyphenyl)-2-[(4-nitrophenyl)methoxycarbonylamino]acetic acid Traditional Name: 2-(3,4-diacetoxyphenyl)-2-[(4-nitrobenzyl)oxycarbonylamino]acetic acid Formula: C20H18N2O10 MolecularWeight: 446.36432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(C(=O)O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(C(=O)O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C20H18N2O10/c1-11(23)31-16-8-5-14(9-17(16)32-12(2)24)18(19(25)26)21-20(27)30-10-13-3-6-15(7-4-13)22(28)29/h3-9,18H,10H2,1-2H3,(H,21,27)(H,25,26)