1-[(4-ethylphenyl)methyl]-4-pentan-3-yl-piperazin-4-ium

Systemtic Name: 1-[(4-ethylphenyl)methyl]-4-pentan-3-yl-piperazin-4-ium Openeye Name: 1-[(4-ethylphenyl)methyl]-4-(1-ethylpropyl)piperazin-4-ium CAS Name: 1-[(4-ethylphenyl)methyl]-4-pentan-3-ylpiperazin-4-ium IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-pentan-3-ylpiperazin-4-ium Traditional Name: 1-(4-ethylbenzyl)-4-(1-ethylpropyl)piperazin-4-ium Formula: C18H31N2+ MolecularWeight: 275.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2/c1-4-16-7-9-17(10-8-16)15-19-11-13-20(14-12-19)18(5-2)6-3/h7-10,18H,4-6,11-15H2,1-3H3/p+1