(2-methoxy-5-nitro-phenyl)methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid (2-methoxy-5-nitro-benzyl) ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H16N2O7/c1-27-16-7-6-13(21(25)26)10-12(16)11-28-17(22)8-9-20-18(23)14-4-2-3-5-15(14)19(20)24/h2-7,10H,8-9,11H2,1H3