methyl 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methyl-pentanoate CAS Name: 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methylpentanoate Traditional Name: 2-[1-(2,4-dimethylphenyl)ethylamino]-4-methyl-valeric acid methyl ester Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC(CC(C)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC(CC(C)C)C(=O)OC)C

InChI

InChI=1S/C17H27NO2/c1-11(2)9-16(17(19)20-6)18-14(5)15-8-7-12(3)10-13(15)4/h7-8,10-11,14,16,18H,9H2,1-6H3