methyl 3-(2-methyl-3-nitro-phenyl)-2-oxidanylidene-propanoate

Systemtic Name: methyl 3-(2-methyl-3-nitro-phenyl)-2-oxidanylidene-propanoate Openeye Name: methyl 3-(2-methyl-3-nitro-phenyl)-2-oxo-propanoate CAS Name: 3-(2-methyl-3-nitrophenyl)-2-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(2-methyl-3-nitrophenyl)-2-oxopropanoate Traditional Name: 2-keto-3-(2-methyl-3-nitro-phenyl)propionic acid methyl ester Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO5/c1-7-8(6-10(13)11(14)17-2)4-3-5-9(7)12(15)16/h3-5H,6H2,1-2H3