2-azaniumylethyl-[(2-methylphenyl)methyl]-prop-2-enyl-azanium

Systemtic Name: 2-azaniumylethyl-[(2-methylphenyl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-(2-azaniumylethyl)-(o-tolylmethyl)ammonium CAS Name: 2-ammonioethyl-[(2-methylphenyl)methyl]-prop-2-enylammonium IUPAC Name: 2-azaniumylethyl-[(2-methylphenyl)methyl]-prop-2-enylazanium Traditional Name: allyl-(2-ammonioethyl)-(2-methylbenzyl)ammonium Formula: C13H22N2+2 MolecularWeight: 206.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](CC[NH3+])CC=C

Isomeric SMILES

CC1=CC=CC=C1C[NH+](CC[NH3+])CC=C

InChI

InChI=1S/C13H20N2/c1-3-9-15(10-8-14)11-13-7-5-4-6-12(13)2/h3-7H,1,8-11,14H2,2H3/p+2