ethyl 5-(2,2-dimethylpropylamino)-4-oxidanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate

Systemtic Name: ethyl 5-(2,2-dimethylpropylamino)-4-oxidanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate Openeye Name: ethyl 5-(2,2-dimethylpropylamino)-3-(1-ethylpropoxy)-4-hydroxy-cyclohexene-1-carboxylate CAS Name: 5-(2,2-dimethylpropylamino)-4-hydroxy-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dimethylpropylamino)-4-hydroxy-3-pentan-3-yloxycyclohexene-1-carboxylate Traditional Name: 3-(1-ethylpropoxy)-4-hydroxy-5-(neopentylamino)cyclohexene-1-carboxylic acid ethyl ester Formula: C19H35NO4 MolecularWeight: 341.4855

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC(C1O)NCC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCC(CC)OC1C=C(CC(C1O)NCC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C19H35NO4/c1-7-14(8-2)24-16-11-13(18(22)23-9-3)10-15(17(16)21)20-12-19(4,5)6/h11,14-17,20-21H,7-10,12H2,1-6H3