2-[(3-methylphenyl)-(2-methylpropanoyl)amino]ethylazanium

Systemtic Name: 2-[(3-methylphenyl)-(2-methylpropanoyl)amino]ethylazanium Openeye Name: 2-[3-methyl-N-(2-methylpropanoyl)anilino]ethylammonium CAS Name: 2-(3-methyl-N-(2-methyl-1-oxopropyl)anilino)ethylammonium IUPAC Name: 2-[3-methyl-N-(2-methylpropanoyl)anilino]ethylazanium Traditional Name: 2-(N-isobutyryl-3-methyl-anilino)ethylammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC[NH3+])C(=O)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC[NH3+])C(=O)C(C)C

InChI

InChI=1S/C13H20N2O/c1-10(2)13(16)15(8-7-14)12-6-4-5-11(3)9-12/h4-6,9-10H,7-8,14H2,1-3H3/p+1