methyl-(quinolin-6-ylmethyl)-[[4-[1-(2-thiophen-3-ylethanoyl)piperidin-4-yl]oxyphenyl]methyl]azanium

Systemtic Name: methyl-(quinolin-6-ylmethyl)-[[4-[1-(2-thiophen-3-ylethanoyl)piperidin-4-yl]oxyphenyl]methyl]azanium Openeye Name: methyl-(6-quinolylmethyl)-[[4-[[1-[2-(3-thienyl)acetyl]-4-piperidyl]oxy]phenyl]methyl]ammonium CAS Name: methyl-[[4-[[1-[1-oxo-2-(3-thiophenyl)ethyl]-4-piperidinyl]oxy]phenyl]methyl]-(6-quinolinylmethyl)ammonium IUPAC Name: methyl-(quinolin-6-ylmethyl)-[[4-[1-(2-thiophen-3-ylacetyl)piperidin-4-yl]oxyphenyl]methyl]azanium Traditional Name: methyl-(6-quinolylmethyl)-[4-[[1-[2-(3-thienyl)acetyl]-4-piperidyl]oxy]benzyl]ammonium Formula: C29H32N3O2S+ MolecularWeight: 486.64828

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)CC3=CSC=C3)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)CC3=CSC=C3)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C29H31N3O2S/c1-31(20-23-6-9-28-25(17-23)3-2-13-30-28)19-22-4-7-26(8-5-22)34-27-10-14-32(15-11-27)29(33)18-24-12-16-35-21-24/h2-9,12-13,16-17,21,27H,10-11,14-15,18-20H2,1H3/p+1