methanesulfonate; 5-methyl-6-[(E)-2-phenylethenyl]phenanthridin-5-ium-3,8-diamine

Systemtic Name: methanesulfonate; 5-methyl-6-[(E)-2-phenylethenyl]phenanthridin-5-ium-3,8-diamine Openeye Name: methanesulfonate; 5-methyl-6-[(E)-styryl]phenanthridin-5-ium-3,8-diamine CAS Name: methanesulfonate; 5-methyl-6-[(E)-2-phenylethenyl]phenanthridin-5-ium-3,8-diamine IUPAC Name: methanesulfonate; 5-methyl-6-[(E)-2-phenylethenyl]phenanthridin-5-ium-3,8-diamine Traditional Name: [3-amino-5-methyl-6-[(E)-styryl]phenanthridin-5-ium-8-yl]amine mesylate Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C=CC4=CC=CC=C4)N)N.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1/C=C/C4=CC=CC=C4)N)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H19N3.CH4O3S/c1-25-21(12-7-15-5-3-2-4-6-15)20-13-16(23)8-10-18(20)19-11-9-17(24)14-22(19)25;1-5(2,3)4/h2-14,24H,23H2,1H3;1H3,(H,2,3,4)/b12-7+;