1-anthracen-9-yl-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]methanimine

Systemtic Name: 1-anthracen-9-yl-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]methanimine Openeye Name: 1-(9-anthryl)-N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]methanimine CAS Name: 1-(9-anthracenyl)-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]methanimine IUPAC Name: 1-anthracen-9-yl-N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]methanimine Traditional Name: 9-anthrylmethylene-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]amine Formula: C32H30N3+ MolecularWeight: 456.6007

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C32H29N3/c1-2-8-25(9-3-1)24-34-18-20-35(21-19-34)29-16-14-28(15-17-29)33-23-32-30-12-6-4-10-26(30)22-27-11-5-7-13-31(27)32/h1-17,22-23H,18-21,24H2/p+1