3-(1-methylpiperidin-1-ium-1-yl)-N-(9H-xanthen-9-yl)butanamide

Systemtic Name: 3-(1-methylpiperidin-1-ium-1-yl)-N-(9H-xanthen-9-yl)butanamide Openeye Name: 3-(1-methylpiperidin-1-ium-1-yl)-N-(9H-xanthen-9-yl)butanamide CAS Name: 3-(1-methyl-1-piperidin-1-iumyl)-N-(9H-xanthen-9-yl)butanamide IUPAC Name: 3-(1-methylpiperidin-1-ium-1-yl)-N-(9H-xanthen-9-yl)butanamide Traditional Name: 3-(1-methylpiperidin-1-ium-1-yl)-N-(9H-xanthen-9-yl)butyramide Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1C2=CC=CC=C2OC3=CC=CC=C13)[N+]4(CCCCC4)C

Isomeric SMILES

CC(CC(=O)NC1C2=CC=CC=C2OC3=CC=CC=C13)[N+]4(CCCCC4)C

InChI

InChI=1S/C23H28N2O2/c1-17(25(2)14-8-3-9-15-25)16-22(26)24-23-18-10-4-6-12-20(18)27-21-13-7-5-11-19(21)23/h4-7,10-13,17,23H,3,8-9,14-16H2,1-2H3/p+1