2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]ethyl 4-cyclohexylcarbonyloxybenzoate dihydrochloride

Systemtic Name: 2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]ethyl 4-cyclohexylcarbonyloxybenzoate dihydrochloride Openeye Name: 2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]ethyl 4-(cyclohexanecarbonyloxy)benzoate dihydrochloride CAS Name: 4-[cyclohexyl(oxo)methoxy]benzoic acid 2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]ethyl ester dihydrochloride IUPAC Name: 2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]ethyl 4-(cyclohexanecarbonyloxy)benzoate dihydrochloride Traditional Name: 4-(cyclohexanecarbonyloxy)benzoic acid 2-[4-(2-keto-2-morpholino-ethyl)piperazino]ethyl ester dihydrochloride Formula: C26H39Cl2N3O6 MolecularWeight: 560.51036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=O)OCCN3CCN(CC3)CC(=O)N4CCOCC4.Cl.Cl

Isomeric SMILES

C1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=O)OCCN3CCN(CC3)CC(=O)N4CCOCC4.Cl.Cl

InChI

InChI=1S/C26H37N3O6.2ClH/c30-24(29-15-17-33-18-16-29)20-28-12-10-27(11-13-28)14-19-34-25(31)22-6-8-23(9-7-22)35-26(32)21-4-2-1-3-5-21;;/h6-9,21H,1-5,10-20H2;2*1H