2-(2-methylphenyl)propan-2-ylazanium; 2-methylpropanedioate

Systemtic Name: 2-(2-methylphenyl)propan-2-ylazanium; 2-methylpropanedioate Openeye Name: [1-methyl-1-(o-tolyl)ethyl]ammonium; 2-methylpropanedioate CAS Name: 2-(2-methylphenyl)propan-2-ylammonium; 2-methylpropanedioate IUPAC Name: 2-(2-methylphenyl)propan-2-ylazanium; 2-methylpropanedioate Traditional Name: 2-methylmalonate; [1-methyl-1-(o-tolyl)ethyl]ammonium Formula: C14H20NO4- MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)(C)[NH3+].CC(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(C)(C)[NH3+].CC(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H15N.C4H6O4/c1-8-6-4-5-7-9(8)10(2,3)11;1-2(3(5)6)4(7)8/h4-7H,11H2,1-3H3;2H,1H3,(H,5,6)(H,7,8)/p-1