O1-acetamido O3-[2-(2-azanyl-5-cyclohexyl-phenyl)-2-oxidanylidene-ethyl] 2,2-diethylpropanedioate

Systemtic Name: O1-acetamido O3-[2-(2-azanyl-5-cyclohexyl-phenyl)-2-oxidanylidene-ethyl] 2,2-diethylpropanedioate Openeye Name: O1-acetamido O3-[2-(2-amino-5-cyclohexyl-phenyl)-2-oxo-ethyl] 2,2-diethylpropanedioate CAS Name: 2,2-diethylpropanedioic acid O1-acetamido ester O3-[2-(2-amino-5-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: 1-O-acetamido 3-O-[2-(2-amino-5-cyclohexylphenyl)-2-oxoethyl] 2,2-diethylpropanedioate Traditional Name: 2,2-diethylmalonic acid O1-acetamido ester O3-[2-(2-amino-5-cyclohexyl-phenyl)-2-keto-ethyl] ester Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)OCC(=O)C1=C(C=CC(=C1)C2CCCCC2)N)C(=O)ONC(=O)C

Isomeric SMILES

CCC(CC)(C(=O)OCC(=O)C1=C(C=CC(=C1)C2CCCCC2)N)C(=O)ONC(=O)C

InChI

InChI=1S/C23H32N2O6/c1-4-23(5-2,22(29)31-25-15(3)26)21(28)30-14-20(27)18-13-17(11-12-19(18)24)16-9-7-6-8-10-16/h11-13,16H,4-10,14,24H2,1-3H3,(H,25,26)