chloromethyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: chloromethyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide Openeye Name: chloromethyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide CAS Name: benzoic acid chloromethyl ester; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide IUPAC Name: chloromethyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide Traditional Name: benzoic acid chloromethyl ester; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)C(=O)OCCl

Isomeric SMILES

CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)C(=O)OCCl

InChI

InChI=1S/C14H22N2O.C8H7ClO2/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4;9-6-11-8(10)7-4-2-1-3-5-7/h7-9H,5-6,10H2,1-4H3,(H,15,17);1-5H,6H2