1-benzothiophen-2-ylmethyl-methyl-[[4-[1-(4-methylphenyl)carbonylpiperidin-4-yl]oxyphenyl]methyl]azanium

Systemtic Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[1-(4-methylphenyl)carbonylpiperidin-4-yl]oxyphenyl]methyl]azanium Openeye Name: benzothiophen-2-ylmethyl-methyl-[[4-[[1-(4-methylbenzoyl)-4-piperidyl]oxy]phenyl]methyl]ammonium CAS Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[[1-[(4-methylphenyl)-oxomethyl]-4-piperidinyl]oxy]phenyl]methyl]ammonium IUPAC Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[1-(4-methylbenzoyl)piperidin-4-yl]oxyphenyl]methyl]azanium Traditional Name: benzothiophen-2-ylmethyl-methyl-[4-[(1-p-toluoyl-4-piperidyl)oxy]benzyl]ammonium Formula: C30H33N2O2S+ MolecularWeight: 485.66022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCC(CC2)OC3=CC=C(C=C3)C[NH+](C)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCC(CC2)OC3=CC=C(C=C3)C[NH+](C)CC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C30H32N2O2S/c1-22-7-11-24(12-8-22)30(33)32-17-15-27(16-18-32)34-26-13-9-23(10-14-26)20-31(2)21-28-19-25-5-3-4-6-29(25)35-28/h3-14,19,27H,15-18,20-21H2,1-2H3/p+1