methyl 4-[(3-methanoyl-1-nitro-cyclohex-3-en-1-yl)methyl]-5,5-dimethyl-hexanoate

Systemtic Name: methyl 4-[(3-methanoyl-1-nitro-cyclohex-3-en-1-yl)methyl]-5,5-dimethyl-hexanoate Openeye Name: methyl 4-[(3-formyl-1-nitro-cyclohex-3-en-1-yl)methyl]-5,5-dimethyl-hexanoate CAS Name: 4-[(3-formyl-1-nitro-1-cyclohex-3-enyl)methyl]-5,5-dimethylhexanoic acid methyl ester IUPAC Name: methyl 4-[(3-formyl-1-nitrocyclohex-3-en-1-yl)methyl]-5,5-dimethylhexanoate Traditional Name: 4-[(3-formyl-1-nitro-cyclohex-3-en-1-yl)methyl]-5,5-dimethyl-hexanoic acid methyl ester Formula: C17H27NO5 MolecularWeight: 325.39998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO5/c1-16(2,3)14(7-8-15(20)23-4)11-17(18(21)22)9-5-6-13(10-17)12-19/h6,12,14H,5,7-11H2,1-4H3