2-(4-ethylpiperazin-1-ium-1-yl)-N-(pyridin-4-ylmethyl)-1,3-dihydroindene-2-carboxamide

Systemtic Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-(pyridin-4-ylmethyl)-1,3-dihydroindene-2-carboxamide Openeye Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-(4-pyridylmethyl)indane-2-carboxamide CAS Name: 2-(4-ethyl-1-piperazin-1-iumyl)-N-(pyridin-4-ylmethyl)-1,3-dihydroindene-2-carboxamide IUPAC Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-(pyridin-4-ylmethyl)-1,3-dihydroindene-2-carboxamide Traditional Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-(4-pyridylmethyl)indane-2-carboxamide Formula: C22H29N4O+ MolecularWeight: 365.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C22H28N4O/c1-2-25-11-13-26(14-12-25)22(15-19-5-3-4-6-20(19)16-22)21(27)24-17-18-7-9-23-10-8-18/h3-10H,2,11-17H2,1H3,(H,24,27)/p+1