N-methyl-N-octadecyl-5-phenyl-phenazin-5-ium-1-amine

Systemtic Name: N-methyl-N-octadecyl-5-phenyl-phenazin-5-ium-1-amine Openeye Name: N-methyl-N-octadecyl-5-phenyl-phenazin-5-ium-1-amine CAS Name: N-methyl-N-octadecyl-5-phenyl-1-phenazin-5-iumamine IUPAC Name: N-methyl-N-octadecyl-5-phenylphenazin-5-ium-1-amine Traditional Name: methyl-(5-phenylphenazin-5-ium-1-yl)-stearyl-amine Formula: C37H52N3+ MolecularWeight: 538.82888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)C1=CC=CC2=[N+](C3=CC=CC=C3N=C21)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)C1=CC=CC2=[N+](C3=CC=CC=C3N=C21)C4=CC=CC=C4

InChI

InChI=1S/C37H52N3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-31-39(2)35-29-24-30-36-37(35)38-33-27-21-22-28-34(33)40(36)32-25-19-18-20-26-32/h18-22,24-30H,3-17,23,31H2,1-2H3/q+1