[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-(morpholin-4-ylmethyl)benzoate

Systemtic Name: [(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-(morpholin-4-ylmethyl)benzoate Openeye Name: [(1R)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 4-(morpholinomethyl)benzoate CAS Name: 4-(4-morpholinylmethyl)benzoic acid [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 4-(morpholin-4-ylmethyl)benzoate Traditional Name: 4-(morpholinomethyl)benzoic acid [(1R)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CC=C(C=C2)CN3CCOCC3

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)OC(=O)C2=CC=C(C=C2)CN3CCOCC3

InChI

InChI=1S/C22H32N2O4/c1-17(21(25)23-15-18-5-3-2-4-6-18)28-22(26)20-9-7-19(8-10-20)16-24-11-13-27-14-12-24/h7-10,17-18H,2-6,11-16H2,1H3,(H,23,25)/t17-/m1/s1