[(1S,2R)-2-(2-methylpropanoyloxy)cyclohexyl] 4-(dimethylamino)benzoate

Systemtic Name: [(1S,2R)-2-(2-methylpropanoyloxy)cyclohexyl] 4-(dimethylamino)benzoate Openeye Name: [(1S,2R)-2-(2-methylpropanoyloxy)cyclohexyl] 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [(1S,2R)-2-(2-methyl-1-oxopropoxy)cyclohexyl] ester IUPAC Name: [(1S,2R)-2-(2-methylpropanoyloxy)cyclohexyl] 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid [(1S,2R)-2-isobutyryloxycyclohexyl] ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1CCCCC1OC(=O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)C(=O)O[C@@H]1CCCC[C@@H]1OC(=O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C19H27NO4/c1-13(2)18(21)23-16-7-5-6-8-17(16)24-19(22)14-9-11-15(12-10-14)20(3)4/h9-13,16-17H,5-8H2,1-4H3/t16-,17+/m1/s1