O1-methyl O3-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(benzylcarbamoylamino)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: 3-O-[2-(benzylcarbamoylamino)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(benzylcarbamoylamino)-2-keto-ethyl] ester O1-methyl ester Formula: C19H17N3O8 MolecularWeight: 415.35358

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H17N3O8/c1-29-17(24)13-7-14(9-15(8-13)22(27)28)18(25)30-11-16(23)21-19(26)20-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H2,20,21,23,26)