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

Systemtic Name: ethyl 3-(2-methyl-3-nitro-phenyl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(2-methyl-3-nitro-phenyl)-3-oxo-propanoate CAS Name: 3-(2-methyl-3-nitrophenyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(2-methyl-3-nitrophenyl)-3-oxopropanoate Traditional Name: 3-keto-3-(2-methyl-3-nitro-phenyl)propionic acid ethyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-3-18-12(15)7-11(14)9-5-4-6-10(8(9)2)13(16)17/h4-6H,3,7H2,1-2H3