N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-9H-xanthene-9-carboxamide Openeye Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-9H-xanthene-9-carboxamide CAS Name: N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-9H-xanthene-9-carboxamide Traditional Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-9H-xanthene-9-carboxamide Formula: C26H33N2O2+ MolecularWeight: 405.55242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)[NH+]5CCCCC5

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)[NH+]5CCCCC5

InChI

InChI=1S/C26H32N2O2/c29-25(27-19-26(15-7-1-8-16-26)28-17-9-2-10-18-28)24-20-11-3-5-13-22(20)30-23-14-6-4-12-21(23)24/h3-6,11-14,24H,1-2,7-10,15-19H2,(H,27,29)/p+1