(2R)-2-[(4-methoxyphenyl)methyl-methyl-azaniumyl]-3-methyl-butanoate

Systemtic Name: (2R)-2-[(4-methoxyphenyl)methyl-methyl-azaniumyl]-3-methyl-butanoate Openeye Name: (2R)-2-[(4-methoxyphenyl)methyl-methyl-ammonio]-3-methyl-butanoate CAS Name: (2R)-2-[(4-methoxyphenyl)methyl-methylammonio]-3-methylbutanoate IUPAC Name: (2R)-2-[(4-methoxyphenyl)methyl-methylazaniumyl]-3-methylbutanoate Traditional Name: (2R)-3-methyl-2-[methyl(p-anisyl)ammonio]butyrate Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])[NH+](C)CC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)[C@H](C(=O)[O-])[NH+](C)CC1=CC=C(C=C1)OC

InChI

InChI=1S/C14H21NO3/c1-10(2)13(14(16)17)15(3)9-11-5-7-12(18-4)8-6-11/h5-8,10,13H,9H2,1-4H3,(H,16,17)/t13-/m1/s1