1-(furan-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-(furan-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazin-1-ium Openeye Name: 1-(2-furylmethyl)-4-(m-tolylmethyl)piperazin-1-ium CAS Name: 1-(2-furanylmethyl)-4-[(3-methylphenyl)methyl]piperazin-1-ium IUPAC Name: 1-(furan-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazin-1-ium Traditional Name: 1-(2-furfuryl)-4-(3-methylbenzyl)piperazin-1-ium Formula: C17H23N2O+ MolecularWeight: 271.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C17H22N2O/c1-15-4-2-5-16(12-15)13-18-7-9-19(10-8-18)14-17-6-3-11-20-17/h2-6,11-12H,7-10,13-14H2,1H3/p+1