6-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenanthridin-5-ium

Systemtic Name: 6-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenanthridin-5-ium Openeye Name: 6-(4-benzylpiperazin-4-ium-1-yl)phenanthridin-5-ium CAS Name: 6-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenanthridin-5-ium IUPAC Name: 6-(4-benzylpiperazin-4-ium-1-yl)phenanthridin-5-ium Traditional Name: 6-(4-benzylpiperazin-4-ium-1-yl)phenanthridin-5-ium Formula: C24H25N3+2 MolecularWeight: 355.4754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=[NH+]C4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=[NH+]C4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C24H23N3/c1-2-8-19(9-3-1)18-26-14-16-27(17-15-26)24-22-12-5-4-10-20(22)21-11-6-7-13-23(21)25-24/h1-13H,14-18H2/p+2