3-methyl-2-phenyl-pentanoic acid; N,N,2,2-tetramethylpropan-1-amine; hydrochloride

Systemtic Name: 3-methyl-2-phenyl-pentanoic acid; N,N,2,2-tetramethylpropan-1-amine; hydrochloride Openeye Name: 3-methyl-2-phenyl-pentanoic acid; N,N,2,2-tetramethylpropan-1-amine; hydrochloride CAS Name: 3-methyl-2-phenylpentanoic acid; N,N,2,2-tetramethyl-1-propanamine; hydrochloride IUPAC Name: 3-methyl-2-phenylpentanoic acid; N,N,2,2-tetramethylpropan-1-amine; hydrochloride Traditional Name: dimethyl(neopentyl)amine; 3-methyl-2-phenyl-valeric acid; hydrochloride Formula: C19H34ClNO2 MolecularWeight: 343.93176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)O.CC(C)(C)CN(C)C.Cl

Isomeric SMILES

CCC(C)C(C1=CC=CC=C1)C(=O)O.CC(C)(C)CN(C)C.Cl

InChI

InChI=1S/C12H16O2.C7H17N.ClH/c1-3-9(2)11(12(13)14)10-7-5-4-6-8-10;1-7(2,3)6-8(4)5;/h4-9,11H,3H2,1-2H3,(H,13,14);6H2,1-5H3;1H