2-azaniumylethyl-[(3-methylphenyl)methyl]-prop-2-enyl-azanium

Systemtic Name: 2-azaniumylethyl-[(3-methylphenyl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-(2-azaniumylethyl)-(m-tolylmethyl)ammonium CAS Name: 2-ammonioethyl-[(3-methylphenyl)methyl]-prop-2-enylammonium IUPAC Name: 2-azaniumylethyl-[(3-methylphenyl)methyl]-prop-2-enylazanium Traditional Name: allyl-(2-ammonioethyl)-(3-methylbenzyl)ammonium Formula: C13H22N2+2 MolecularWeight: 206.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+](CC[NH3+])CC=C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+](CC[NH3+])CC=C

InChI

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