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

Systemtic Name: [4-(1H-indol-3-yl)piperidin-1-yl]-[4-(piperidin-1-ium-1-ylmethyl)phenyl]methanone Openeye Name: [4-(1H-indol-3-yl)-1-piperidyl]-[4-(piperidin-1-ium-1-ylmethyl)phenyl]methanone CAS Name: [4-(1H-indol-3-yl)-1-piperidinyl]-[4-(1-piperidin-1-iumylmethyl)phenyl]methanone IUPAC Name: [4-(1H-indol-3-yl)piperidin-1-yl]-[4-(piperidin-1-ium-1-ylmethyl)phenyl]methanone Traditional Name: [4-(1H-indol-3-yl)piperidino]-[4-(piperidin-1-ium-1-ylmethyl)phenyl]methanone Formula: C26H32N3O+ MolecularWeight: 402.55178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H31N3O/c30-26(22-10-8-20(9-11-22)19-28-14-4-1-5-15-28)29-16-12-21(13-17-29)24-18-27-25-7-3-2-6-23(24)25/h2-3,6-11,18,21,27H,1,4-5,12-17,19H2/p+1