1-[(10-chloranylanthracen-9-yl)methyl]-4-pyridin-1-ium-2-yl-piperazin-1-ium

Systemtic Name: 1-[(10-chloranylanthracen-9-yl)methyl]-4-pyridin-1-ium-2-yl-piperazin-1-ium Openeye Name: 1-[(10-chloro-9-anthryl)methyl]-4-pyridin-1-ium-2-yl-piperazin-1-ium CAS Name: 1-[(10-chloro-9-anthracenyl)methyl]-4-(2-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-[(10-chloroanthracen-9-yl)methyl]-4-pyridin-1-ium-2-ylpiperazin-1-ium Traditional Name: 1-[(10-chloro-9-anthryl)methyl]-4-pyridin-1-ium-2-yl-piperazin-1-ium Formula: C24H24ClN3+2 MolecularWeight: 389.92046

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C3C=CC=CC3=C(C4=CC=CC=C42)Cl)C5=CC=CC=[NH+]5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C3C=CC=CC3=C(C4=CC=CC=C42)Cl)C5=CC=CC=[NH+]5

InChI

InChI=1S/C24H22ClN3/c25-24-20-9-3-1-7-18(20)22(19-8-2-4-10-21(19)24)17-27-13-15-28(16-14-27)23-11-5-6-12-26-23/h1-12H,13-17H2/p+2