methyl 2-[1-[3,4-bis(fluoranyl)phenyl]ethylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[1-[3,4-bis(fluoranyl)phenyl]ethylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[1-(3,4-difluorophenyl)ethylamino]-3-methyl-pentanoate CAS Name: 2-[1-(3,4-difluorophenyl)ethylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[1-(3,4-difluorophenyl)ethylamino]-3-methylpentanoate Traditional Name: 2-[1-(3,4-difluorophenyl)ethylamino]-3-methyl-valeric acid methyl ester Formula: C15H21F2NO2 MolecularWeight: 285.329546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(C)C1=CC(=C(C=C1)F)F

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(C)C1=CC(=C(C=C1)F)F

InChI

InChI=1S/C15H21F2NO2/c1-5-9(2)14(15(19)20-4)18-10(3)11-6-7-12(16)13(17)8-11/h6-10,14,18H,5H2,1-4H3