diethyl 2-acetamido-2-[2-(2-azanyl-5-cyclohexyl-phenyl)-2-oxidanylidene-ethyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[2-(2-azanyl-5-cyclohexyl-phenyl)-2-oxidanylidene-ethyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[2-(2-amino-5-cyclohexyl-phenyl)-2-oxo-ethyl]propanedioate CAS Name: 2-acetamido-2-[2-(2-amino-5-cyclohexylphenyl)-2-oxoethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[2-(2-amino-5-cyclohexylphenyl)-2-oxoethyl]propanedioate Traditional Name: 2-acetamido-2-[2-(2-amino-5-cyclohexyl-phenyl)-2-keto-ethyl]malonic acid diethyl ester Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=C(C=CC(=C1)C2CCCCC2)N)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=C(C=CC(=C1)C2CCCCC2)N)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C23H32N2O6/c1-4-30-21(28)23(25-15(3)26,22(29)31-5-2)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)