2-[4-(anthracen-9-ylmethyl)piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-(anthracen-9-ylmethyl)piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-(9-anthrylmethyl)piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-(9-anthracenylmethyl)-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-(anthracen-9-ylmethyl)piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-(9-anthrylmethyl)piperazin-4-ium-1-yl]ethanol Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42)CCO

Isomeric SMILES

C1CN(CC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42)CCO

InChI

InChI=1S/C21H24N2O/c24-14-13-22-9-11-23(12-10-22)16-21-19-7-3-1-5-17(19)15-18-6-2-4-8-20(18)21/h1-8,15,24H,9-14,16H2/p+1