6-phenyl-5-[3-[[1-(phenylmethyl)piperidin-4-yl]amino]propyl]phenanthridin-5-ium-3,8-diamine

Systemtic Name: 6-phenyl-5-[3-[[1-(phenylmethyl)piperidin-4-yl]amino]propyl]phenanthridin-5-ium-3,8-diamine Openeye Name: 5-[3-[(1-benzyl-4-piperidyl)amino]propyl]-6-phenyl-phenanthridin-5-ium-3,8-diamine CAS Name: 6-phenyl-5-[3-[[1-(phenylmethyl)-4-piperidinyl]amino]propyl]phenanthridin-5-ium-3,8-diamine IUPAC Name: 5-[3-[(1-benzylpiperidin-4-yl)amino]propyl]-6-phenylphenanthridin-5-ium-3,8-diamine Traditional Name: (1-benzyl-4-piperidyl)-[3-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)propyl]amine Formula: C34H38N5+ MolecularWeight: 516.69902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCC[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=C2C5=CC=CC=C5)N)N)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1NCCC[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=C2C5=CC=CC=C5)N)N)CC6=CC=CC=C6

InChI

InChI=1S/C34H37N5/c35-27-12-14-30-31-15-13-28(36)23-33(31)39(34(32(30)22-27)26-10-5-2-6-11-26)19-7-18-37-29-16-20-38(21-17-29)24-25-8-3-1-4-9-25/h1-6,8-15,22-23,29,36-37H,7,16-21,24,35H2/p+1