1-(anthracen-9-ylmethyl)-4-(3-chlorophenyl)piperazin-1-ium

Systemtic Name: 1-(anthracen-9-ylmethyl)-4-(3-chlorophenyl)piperazin-1-ium Openeye Name: 1-(9-anthrylmethyl)-4-(3-chlorophenyl)piperazin-1-ium CAS Name: 1-(9-anthracenylmethyl)-4-(3-chlorophenyl)piperazin-1-ium IUPAC Name: 1-(anthracen-9-ylmethyl)-4-(3-chlorophenyl)piperazin-1-ium Traditional Name: 1-(9-anthrylmethyl)-4-(3-chlorophenyl)piperazin-1-ium Formula: C25H24ClN2+ MolecularWeight: 387.92446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H23ClN2/c26-21-8-5-9-22(17-21)28-14-12-27(13-15-28)18-25-23-10-3-1-6-19(23)16-20-7-2-4-11-24(20)25/h1-11,16-17H,12-15,18H2/p+1