1-(3-piperidin-1-ium-1-ylpropyl)-3-(5-thiophen-3-ylpyridin-1-ium-3-yl)indole

Systemtic Name: 1-(3-piperidin-1-ium-1-ylpropyl)-3-(5-thiophen-3-ylpyridin-1-ium-3-yl)indole Openeye Name: 1-(3-piperidin-1-ium-1-ylpropyl)-3-[5-(3-thienyl)pyridin-1-ium-3-yl]indole CAS Name: 1-[3-(1-piperidin-1-iumyl)propyl]-3-[5-(3-thiophenyl)-3-pyridin-1-iumyl]indole IUPAC Name: 1-(3-piperidin-1-ium-1-ylpropyl)-3-(5-thiophen-3-ylpyridin-1-ium-3-yl)indole Traditional Name: 1-(3-piperidin-1-ium-1-ylpropyl)-3-[5-(3-thienyl)pyridin-1-ium-3-yl]indole Formula: C25H29N3S+2 MolecularWeight: 403.58286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCN2C=C(C3=CC=CC=C32)C4=C[NH+]=CC(=C4)C5=CSC=C5

Isomeric SMILES

C1CC[NH+](CC1)CCCN2C=C(C3=CC=CC=C32)C4=C[NH+]=CC(=C4)C5=CSC=C5

InChI

InChI=1S/C25H27N3S/c1-4-10-27(11-5-1)12-6-13-28-18-24(23-7-2-3-8-25(23)28)22-15-21(16-26-17-22)20-9-14-29-19-20/h2-3,7-9,14-19H,1,4-6,10-13H2/p+2