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

Systemtic Name: 1-[(4-ethylphenyl)methyl]-4-(furan-2-ylmethyl)piperazin-4-ium Openeye Name: 1-[(4-ethylphenyl)methyl]-4-(2-furylmethyl)piperazin-4-ium CAS Name: 1-[(4-ethylphenyl)methyl]-4-(2-furanylmethyl)piperazin-4-ium IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-(furan-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(4-ethylbenzyl)-4-(2-furfuryl)piperazin-4-ium Formula: C18H25N2O+ MolecularWeight: 285.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C18H24N2O/c1-2-16-5-7-17(8-6-16)14-19-9-11-20(12-10-19)15-18-4-3-13-21-18/h3-8,13H,2,9-12,14-15H2,1H3/p+1