N-[1-[[(1E)-cyclononen-1-yl]methyl]-1-ethyl-piperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[1-[[(1E)-cyclononen-1-yl]methyl]-1-ethyl-piperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[1-[[(1E)-cyclononen-1-yl]methyl]-1-ethyl-piperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide CAS Name: N-[1-[[(1E)-1-cyclononenyl]methyl]-1-ethyl-4-piperidin-1-iumyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[1-[[(1E)-cyclononen-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[1-[[(1E)-cyclononen-1-yl]methyl]-1-ethyl-piperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide Formula: C31H41N2O2+ MolecularWeight: 473.66944

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCC(CC1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)CC5=CCCCCCCC5

Isomeric SMILES

CC[N+]1(CCC(CC1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C/C/5=C/CCCCCCC5

InChI

InChI=1S/C31H40N2O2/c1-2-33(23-24-13-7-5-3-4-6-8-14-24)21-19-25(20-22-33)32-31(34)30-26-15-9-11-17-28(26)35-29-18-12-10-16-27(29)30/h9-13,15-18,25,30H,2-8,14,19-23H2,1H3/p+1/b24-13+