acetyloxymethyl 4-[4-[4-(2-acetyloxy-1-cyclohexyl-2-oxidanylidene-ethoxy)phenyl]-3-oxidanylidene-piperazin-1-yl]piperidine-1-carboxylate hydrochloride

Systemtic Name: acetyloxymethyl 4-[4-[4-(2-acetyloxy-1-cyclohexyl-2-oxidanylidene-ethoxy)phenyl]-3-oxidanylidene-piperazin-1-yl]piperidine-1-carboxylate hydrochloride Openeye Name: acetoxymethyl 4-[4-[4-(2-acetoxy-1-cyclohexyl-2-oxo-ethoxy)phenyl]-3-oxo-piperazin-1-yl]piperidine-1-carboxylate hydrochloride CAS Name: 4-[4-[4-(2-acetyloxy-1-cyclohexyl-2-oxoethoxy)phenyl]-3-oxo-1-piperazinyl]-1-piperidinecarboxylic acid acetyloxymethyl ester hydrochloride IUPAC Name: acetyloxymethyl 4-[4-[4-(2-acetyloxy-1-cyclohexyl-2-oxoethoxy)phenyl]-3-oxopiperazin-1-yl]piperidine-1-carboxylate hydrochloride Traditional Name: 4-[4-[4-(2-acetoxy-1-cyclohexyl-2-keto-ethoxy)phenyl]-3-keto-piperazino]piperidine-1-carboxylic acid acetoxymethyl ester hydrochloride Formula: C29H40ClN3O9 MolecularWeight: 610.0956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)N1CCC(CC1)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC(C4CCCCC4)C(=O)OC(=O)C.Cl

Isomeric SMILES

CC(=O)OCOC(=O)N1CCC(CC1)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC(C4CCCCC4)C(=O)OC(=O)C.Cl

InChI

InChI=1S/C29H39N3O9.ClH/c1-20(33)38-19-39-29(37)30-14-12-23(13-15-30)31-16-17-32(26(35)18-31)24-8-10-25(11-9-24)41-27(28(36)40-21(2)34)22-6-4-3-5-7-22;/h8-11,22-23,27H,3-7,12-19H2,1-2H3;1H