1-(dimethylamino)propan-2-yl 2-(2-ethyl-2-methyl-4-phenyl-oxan-4-yl)ethanoate hydrochloride

Systemtic Name: 1-(dimethylamino)propan-2-yl 2-(2-ethyl-2-methyl-4-phenyl-oxan-4-yl)ethanoate hydrochloride Openeye Name: [2-(dimethylamino)-1-methyl-ethyl] 2-(2-ethyl-2-methyl-4-phenyl-tetrahydropyran-4-yl)acetate hydrochloride CAS Name: 2-(2-ethyl-2-methyl-4-phenyl-4-oxanyl)acetic acid 1-(dimethylamino)propan-2-yl ester hydrochloride IUPAC Name: 1-(dimethylamino)propan-2-yl 2-(2-ethyl-2-methyl-4-phenyloxan-4-yl)acetate hydrochloride Traditional Name: 2-(2-ethyl-2-methyl-4-phenyl-tetrahydropyran-4-yl)acetic acid [2-(dimethylamino)-1-methyl-ethyl] ester hydrochloride Formula: C21H34ClNO3 MolecularWeight: 383.95256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CC(=O)OC(C)CN(C)C)C2=CC=CC=C2)C.Cl

Isomeric SMILES

CCC1(CC(CCO1)(CC(=O)OC(C)CN(C)C)C2=CC=CC=C2)C.Cl

InChI

InChI=1S/C21H33NO3.ClH/c1-6-20(3)16-21(12-13-24-20,18-10-8-7-9-11-18)14-19(23)25-17(2)15-22(4)5;/h7-11,17H,6,12-16H2,1-5H3;1H