1-bromanyl-4-methyl-benzene; 3-(dimethylamino)-2-methyl-propanoic acid

Systemtic Name: 1-bromanyl-4-methyl-benzene; 3-(dimethylamino)-2-methyl-propanoic acid Openeye Name: 1-bromo-4-methyl-benzene; 3-(dimethylamino)-2-methyl-propanoic acid CAS Name: 1-bromo-4-methylbenzene; 3-(dimethylamino)-2-methylpropanoic acid IUPAC Name: 1-bromo-4-methylbenzene; 3-(dimethylamino)-2-methylpropanoic acid Traditional Name: 1-bromo-4-methyl-benzene; 3-(dimethylamino)-2-methyl-propionic acid Formula: C13H20BrNO2 MolecularWeight: 302.2074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)Br.CC(CN(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)Br.CC(CN(C)C)C(=O)O

InChI

InChI=1S/C7H7Br.C6H13NO2/c1-6-2-4-7(8)5-3-6;1-5(6(8)9)4-7(2)3/h2-5H,1H3;5H,4H2,1-3H3,(H,8,9)