2,2,2-tris(chloranyl)ethyl 4-methyl-3-[(phenylmethyl)amino]pentanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 4-methyl-3-[(phenylmethyl)amino]pentanoate Openeye Name: 2,2,2-trichloroethyl 3-(benzylamino)-4-methyl-pentanoate CAS Name: 4-methyl-3-[(phenylmethyl)amino]pentanoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-(benzylamino)-4-methylpentanoate Traditional Name: 3-(benzylamino)-4-methyl-valeric acid 2,2,2-trichloroethyl ester Formula: C15H20Cl3NO2 MolecularWeight: 352.6838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)OCC(Cl)(Cl)Cl)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(CC(=O)OCC(Cl)(Cl)Cl)NCC1=CC=CC=C1

InChI

InChI=1S/C15H20Cl3NO2/c1-11(2)13(8-14(20)21-10-15(16,17)18)19-9-12-6-4-3-5-7-12/h3-7,11,13,19H,8-10H2,1-2H3