2-azanyl-3-methyl-butanoic acid; methylbenzene

Systemtic Name: 2-azanyl-3-methyl-butanoic acid; methylbenzene Openeye Name: 2-amino-3-methyl-butanoic acid; toluene CAS Name: 2-amino-3-methylbutanoic acid; toluene IUPAC Name: 2-amino-3-methylbutanoic acid; toluene Traditional Name: 2-amino-3-methyl-butyric acid; toluene Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC(C)C(C(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1.CC(C)C(C(=O)O)N

InChI

InChI=1S/C7H8.C5H11NO2/c1-7-5-3-2-4-6-7;1-3(2)4(6)5(7)8/h2-6H,1H3;3-4H,6H2,1-2H3,(H,7,8)