1-(2-ethoxyphenyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(2-ethoxyphenyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium Openeye Name: 1-(2-ethoxyphenyl)-4-(3-thienylmethyl)piperazin-4-ium CAS Name: 1-(2-ethoxyphenyl)-4-(3-thiophenylmethyl)piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium Traditional Name: 1-o-phenetyl-4-(3-thenyl)piperazin-4-ium Formula: C17H23N2OS+ MolecularWeight: 303.44232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CSC=C3

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CSC=C3

InChI

InChI=1S/C17H22N2OS/c1-2-20-17-6-4-3-5-16(17)19-10-8-18(9-11-19)13-15-7-12-21-14-15/h3-7,12,14H,2,8-11,13H2,1H3/p+1