[3-[1-(dimethylamino)-4-oxidanylidene-cyclohexyl]phenyl] propanoate

Systemtic Name: [3-[1-(dimethylamino)-4-oxidanylidene-cyclohexyl]phenyl] propanoate Openeye Name: [3-[1-(dimethylamino)-4-oxo-cyclohexyl]phenyl] propanoate CAS Name: propanoic acid [3-[1-(dimethylamino)-4-oxocyclohexyl]phenyl] ester IUPAC Name: [3-[1-(dimethylamino)-4-oxocyclohexyl]phenyl] propanoate Traditional Name: propionic acid [3-[1-(dimethylamino)-4-keto-cyclohexyl]phenyl] ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)C2(CCC(=O)CC2)N(C)C

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)C2(CCC(=O)CC2)N(C)C

InChI

InChI=1S/C17H23NO3/c1-4-16(20)21-15-7-5-6-13(12-15)17(18(2)3)10-8-14(19)9-11-17/h5-7,12H,4,8-11H2,1-3H3