[4-[1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone Openeye Name: [4-[1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-(1-piperidyl)methanone CAS Name: [4-[[1-(1H-indol-3-ylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-[1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidino-methanone Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H31N3O2/c30-26(29-14-4-1-5-15-29)20-8-10-22(11-9-20)31-23-12-16-28(17-13-23)19-21-18-27-25-7-3-2-6-24(21)25/h2-3,6-11,18,23,27H,1,4-5,12-17,19H2/p+1