methyl 2-[(3,4-dimethylphenyl)methylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(3,4-dimethylphenyl)methylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(3,4-dimethylphenyl)methylamino]-4-methyl-pentanoate CAS Name: 2-[(3,4-dimethylphenyl)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3,4-dimethylphenyl)methylamino]-4-methylpentanoate Traditional Name: 2-[(3,4-dimethylbenzyl)amino]-4-methyl-valeric acid methyl ester Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2/c1-11(2)8-15(16(18)19-5)17-10-14-7-6-12(3)13(4)9-14/h6-7,9,11,15,17H,8,10H2,1-5H3