1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazine

Systemtic Name: 1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazine CAS Name: 1-[1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumyl]-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[1-(4-ethylbenzyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazine Formula: C25H36N3O+ MolecularWeight: 394.57284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H35N3O/c1-3-21-8-10-22(11-9-21)20-26-14-12-23(13-15-26)27-16-18-28(19-17-27)24-6-4-5-7-25(24)29-2/h4-11,23H,3,12-20H2,1-2H3/p+1