2-(2-methylpropanoylamino)ethyl-[(1-methylpyrrol-2-yl)methyl]azanium

Systemtic Name: 2-(2-methylpropanoylamino)ethyl-[(1-methylpyrrol-2-yl)methyl]azanium Openeye Name: 2-(2-methylpropanoylamino)ethyl-[(1-methylpyrrol-2-yl)methyl]ammonium CAS Name: 2-[(2-methyl-1-oxopropyl)amino]ethyl-[(1-methyl-2-pyrrolyl)methyl]ammonium IUPAC Name: 2-(2-methylpropanoylamino)ethyl-[(1-methylpyrrol-2-yl)methyl]azanium Traditional Name: 2-(isobutyrylamino)ethyl-[(1-methylpyrrol-2-yl)methyl]ammonium Formula: C12H22N3O+ MolecularWeight: 224.32258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC[NH2+]CC1=CC=CN1C

Isomeric SMILES

CC(C)C(=O)NCC[NH2+]CC1=CC=CN1C

InChI

InChI=1S/C12H21N3O/c1-10(2)12(16)14-7-6-13-9-11-5-4-8-15(11)3/h4-5,8,10,13H,6-7,9H2,1-3H3,(H,14,16)/p+1