2-diethylaminoethyl 2-(3-methyl-1-oxidanyl-cyclohexyl)-2-phenyl-ethanoate chloride

Systemtic Name: 2-diethylaminoethyl 2-(3-methyl-1-oxidanyl-cyclohexyl)-2-phenyl-ethanoate chloride Openeye Name: 2-diethylaminoethyl 2-(1-hydroxy-3-methyl-cyclohexyl)-2-phenyl-acetate chloride CAS Name: 2-(1-hydroxy-3-methylcyclohexyl)-2-phenylacetic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 2-(1-hydroxy-3-methylcyclohexyl)-2-phenylacetate chloride Traditional Name: 2-(1-hydroxy-3-methyl-cyclohexyl)-2-phenyl-acetic acid 2-diethylaminoethyl ester chloride Formula: C21H33ClNO3- MolecularWeight: 382.94462

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2(CCCC(C2)C)O.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2(CCCC(C2)C)O.[Cl-]

InChI

InChI=1S/C21H33NO3.ClH/c1-4-22(5-2)14-15-25-20(23)19(18-11-7-6-8-12-18)21(24)13-9-10-17(3)16-21;/h6-8,11-12,17,19,24H,4-5,9-10,13-16H2,1-3H3;1H/p-1