1-phenoxyethyl 2-(dimethylamino)-2-methyl-3-(1-oxidanylcyclohexyl)butanoate

Systemtic Name: 1-phenoxyethyl 2-(dimethylamino)-2-methyl-3-(1-oxidanylcyclohexyl)butanoate Openeye Name: 1-phenoxyethyl 2-(dimethylamino)-3-(1-hydroxycyclohexyl)-2-methyl-butanoate CAS Name: 2-(dimethylamino)-3-(1-hydroxycyclohexyl)-2-methylbutanoic acid 1-phenoxyethyl ester IUPAC Name: 1-phenoxyethyl 2-(dimethylamino)-3-(1-hydroxycyclohexyl)-2-methylbutanoate Traditional Name: 2-(dimethylamino)-3-(1-hydroxycyclohexyl)-2-methyl-butyric acid 1-phenoxyethyl ester Formula: C21H33NO4 MolecularWeight: 363.49102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CCCCC1)O)C(C)(C(=O)OC(C)OC2=CC=CC=C2)N(C)C

Isomeric SMILES

CC(C1(CCCCC1)O)C(C)(C(=O)OC(C)OC2=CC=CC=C2)N(C)C

InChI

InChI=1S/C21H33NO4/c1-16(21(24)14-10-7-11-15-21)20(3,22(4)5)19(23)26-17(2)25-18-12-8-6-9-13-18/h6,8-9,12-13,16-17,24H,7,10-11,14-15H2,1-5H3