anthracen-9-yl-[4-(1-oxidanidylpiperidin-1-ium-1-yl)piperidin-1-yl]methanone

Systemtic Name: anthracen-9-yl-[4-(1-oxidanidylpiperidin-1-ium-1-yl)piperidin-1-yl]methanone Openeye Name: 9-anthryl-[4-(1-oxidopiperidin-1-ium-1-yl)-1-piperidyl]methanone CAS Name: 9-anthracenyl-[4-(1-oxido-1-piperidin-1-iumyl)-1-piperidinyl]methanone IUPAC Name: anthracen-9-yl-[4-(1-oxidopiperidin-1-ium-1-yl)piperidin-1-yl]methanone Traditional Name: 9-anthryl-[4-(1-oxidopiperidin-1-ium-1-yl)piperidino]methanone Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C2CCN(CC2)C(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53)[O-]

Isomeric SMILES

C1CC[N+](CC1)(C2CCN(CC2)C(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53)[O-]

InChI

InChI=1S/C25H28N2O2/c28-25(26-14-12-21(13-15-26)27(29)16-6-1-7-17-27)24-22-10-4-2-8-19(22)18-20-9-3-5-11-23(20)24/h2-5,8-11,18,21H,1,6-7,12-17H2