(4-methoxyphenyl)methyl-dimethyl-(2-methyl-3-phenothiazin-10-yl-propyl)azanium

Systemtic Name: (4-methoxyphenyl)methyl-dimethyl-(2-methyl-3-phenothiazin-10-yl-propyl)azanium Openeye Name: (4-methoxyphenyl)methyl-dimethyl-(2-methyl-3-phenothiazin-10-yl-propyl)ammonium CAS Name: (4-methoxyphenyl)methyl-dimethyl-[2-methyl-3-(10-phenothiazinyl)propyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-dimethyl-(2-methyl-3-phenothiazin-10-ylpropyl)azanium Traditional Name: dimethyl-(2-methyl-3-phenothiazin-10-yl-propyl)-p-anisyl-ammonium Formula: C26H31N2OS+ MolecularWeight: 419.60214

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)C[N+](C)(C)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)C[N+](C)(C)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N2OS/c1-20(18-28(2,3)19-21-13-15-22(29-4)16-14-21)17-27-23-9-5-7-11-25(23)30-26-12-8-6-10-24(26)27/h5-16,20H,17-19H2,1-4H3/q+1