2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; (phenylmethyl) octanoate

Systemtic Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; (phenylmethyl) octanoate Openeye Name: benzyl octanoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; octanoic acid (phenylmethyl) ester IUPAC Name: benzyl octanoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide Traditional Name: caprylic acid benzyl ester; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide Formula: C29H44N2O3 MolecularWeight: 468.67126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC1=CC=CC=C1.CCN(CC)CC(=O)NC1=C(C=CC=C1C)C

Isomeric SMILES

CCCCCCCC(=O)OCC1=CC=CC=C1.CCN(CC)CC(=O)NC1=C(C=CC=C1C)C

InChI

InChI=1S/C15H22O2.C14H22N2O/c1-2-3-4-5-9-12-15(16)17-13-14-10-7-6-8-11-14;1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h6-8,10-11H,2-5,9,12-13H2,1H3;7-9H,5-6,10H2,1-4H3,(H,15,17)