methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)amino]-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)amino]-3-(4-nitrophenyl)propanoate Openeye Name: methyl 2-[(2-methoxy-2-oxo-ethyl)amino]-3-(4-nitrophenyl)propanoate CAS Name: 2-[(2-methoxy-2-oxoethyl)amino]-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2-methoxy-2-oxoethyl)amino]-3-(4-nitrophenyl)propanoate Traditional Name: 2-[(2-keto-2-methoxy-ethyl)amino]-3-(4-nitrophenyl)propionic acid methyl ester Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)CNC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H16N2O6/c1-20-12(16)8-14-11(13(17)21-2)7-9-3-5-10(6-4-9)15(18)19/h3-6,11,14H,7-8H2,1-2H3