ethyl (1E)-4,4-dimethyl-N-[4-(4-nitrophenyl)butanoyl]-3-oxidanylidene-pentanehydrazonate

Systemtic Name: ethyl (1E)-4,4-dimethyl-N-[4-(4-nitrophenyl)butanoyl]-3-oxidanylidene-pentanehydrazonate Openeye Name: ethyl (1E)-4,4-dimethyl-N-[4-(4-nitrophenyl)butanoyl]-3-oxo-pentanehydrazonate CAS Name: (1E)-4,4-dimethyl-N-[4-(4-nitrophenyl)-1-oxobutyl]-3-oxopentanehydrazonic acid ethyl ester IUPAC Name: ethyl (1E)-4,4-dimethyl-N-[4-(4-nitrophenyl)butanoyl]-3-oxopentanehydrazonate Traditional Name: (1E)-3-keto-4,4-dimethyl-N-[4-(4-nitrophenyl)butanoyl]valerohydrazonic acid ethyl ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NNC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)C(C)(C)C

Isomeric SMILES

CCO/C(=N/NC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-])/CC(=O)C(C)(C)C

InChI

InChI=1S/C19H27N3O5/c1-5-27-18(13-16(23)19(2,3)4)21-20-17(24)8-6-7-14-9-11-15(12-10-14)22(25)26/h9-12H,5-8,13H2,1-4H3,(H,20,24)/b21-18+