[4-[2-(dimethylamino)-1-(1-oxidanylcyclohexyl)ethyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[2-(dimethylamino)-1-(1-oxidanylcyclohexyl)ethyl]phenyl] furan-2-carboxylate Openeye Name: [4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=CC=C(C=C1)OC(=O)C2=CC=CO2)C3(CCCCC3)O

Isomeric SMILES

CN(C)CC(C1=CC=C(C=C1)OC(=O)C2=CC=CO2)C3(CCCCC3)O

InChI

InChI=1S/C21H27NO4/c1-22(2)15-18(21(24)12-4-3-5-13-21)16-8-10-17(11-9-16)26-20(23)19-7-6-14-25-19/h6-11,14,18,24H,3-5,12-13,15H2,1-2H3