2-[3-(3,4-dimethylphenoxy)propylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[3-(3,4-dimethylphenoxy)propylamino]-2-methyl-pentanoic acid Openeye Name: 2-[3-(3,4-dimethylphenoxy)propylamino]-2-methyl-pentanoic acid CAS Name: 2-[3-(3,4-dimethylphenoxy)propylamino]-2-methylpentanoic acid IUPAC Name: 2-[3-(3,4-dimethylphenoxy)propylamino]-2-methylpentanoic acid Traditional Name: 2-[3-(3,4-dimethylphenoxy)propylamino]-2-methyl-valeric acid Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NCCCOC1=CC(=C(C=C1)C)C

Isomeric SMILES

CCCC(C)(C(=O)O)NCCCOC1=CC(=C(C=C1)C)C

InChI

InChI=1S/C17H27NO3/c1-5-9-17(4,16(19)20)18-10-6-11-21-15-8-7-13(2)14(3)12-15/h7-8,12,18H,5-6,9-11H2,1-4H3,(H,19,20)