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

Systemtic Name: O1-acetamido O3-[2-(2-azanyl-5-propyl-phenyl)-2-oxidanylidene-ethyl] 2,2-diethylpropanedioate Openeye Name: O1-acetamido O3-[2-(2-amino-5-propyl-phenyl)-2-oxo-ethyl] 2,2-diethylpropanedioate CAS Name: 2,2-diethylpropanedioic acid O1-acetamido ester O3-[2-(2-amino-5-propylphenyl)-2-oxoethyl] ester IUPAC Name: 1-O-acetamido 3-O-[2-(2-amino-5-propylphenyl)-2-oxoethyl] 2,2-diethylpropanedioate Traditional Name: 2,2-diethylmalonic acid O1-acetamido ester O3-[2-(2-amino-5-propyl-phenyl)-2-keto-ethyl] ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)N)C(=O)COC(=O)C(CC)(CC)C(=O)ONC(=O)C

Isomeric SMILES

CCCC1=CC(=C(C=C1)N)C(=O)COC(=O)C(CC)(CC)C(=O)ONC(=O)C

InChI

InChI=1S/C20H28N2O6/c1-5-8-14-9-10-16(21)15(11-14)17(24)12-27-18(25)20(6-2,7-3)19(26)28-22-13(4)23/h9-11H,5-8,12,21H2,1-4H3,(H,22,23)