(NE)-N-ethylidenehydroxylamine; (4,7,7-trimethyl-5-oxidanylidene-2-piperidin-1-yl-cyclohept-3-en-1-yl) ethanoate

Systemtic Name: (NE)-N-ethylidenehydroxylamine; (4,7,7-trimethyl-5-oxidanylidene-2-piperidin-1-yl-cyclohept-3-en-1-yl) ethanoate Openeye Name: (1E)-acetaldehyde oxime; [4,7,7-trimethyl-5-oxo-2-(1-piperidyl)cyclohept-3-en-1-yl] acetate CAS Name: (1E)-acetaldehyde oxime; acetic acid [4,7,7-trimethyl-5-oxo-2-(1-piperidinyl)-1-cyclohept-3-enyl] ester IUPAC Name: (NE)-N-ethylidenehydroxylamine; (4,7,7-trimethyl-5-oxo-2-piperidin-1-ylcyclohept-3-en-1-yl) acetate Traditional Name: (1E)-acetaldoxime; acetic acid (5-keto-4,7,7-trimethyl-2-piperidino-cyclohept-3-en-1-yl) ester Formula: C19H32N2O4 MolecularWeight: 352.46838

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Descriptors Computed from Structure

Canonical SMILES:

CC=NO.CC1=CC(C(C(CC1=O)(C)C)OC(=O)C)N2CCCCC2

Isomeric SMILES

C/C=N/O.CC1=CC(C(C(CC1=O)(C)C)OC(=O)C)N2CCCCC2

InChI

InChI=1S/C17H27NO3.C2H5NO/c1-12-10-14(18-8-6-5-7-9-18)16(21-13(2)19)17(3,4)11-15(12)20;1-2-3-4/h10,14,16H,5-9,11H2,1-4H3;2,4H,1H3/b;3-2+