[4-[3-(2-chloranylphenothiazin-10-yl)propyl-dimethyl-azaniumyl]phenyl]methanolate

Systemtic Name: [4-[3-(2-chloranylphenothiazin-10-yl)propyl-dimethyl-azaniumyl]phenyl]methanolate Openeye Name: [4-[3-(2-chlorophenothiazin-10-yl)propyl-dimethyl-ammonio]phenyl]methanolate CAS Name: [4-[3-(2-chloro-10-phenothiazinyl)propyl-dimethylammonio]phenyl]methanolate IUPAC Name: [4-[3-(2-chlorophenothiazin-10-yl)propyl-dimethylazaniumyl]phenyl]methanolate Traditional Name: [4-[3-(2-chlorophenothiazin-10-yl)propyl-dimethyl-ammonio]phenyl]methanolate Formula: C24H25ClN2OS MolecularWeight: 424.9861

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)C4=CC=C(C=C4)C[O-]

Isomeric SMILES

C[N+](C)(CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)C4=CC=C(C=C4)C[O-]

InChI

InChI=1S/C24H25ClN2OS/c1-27(2,20-11-8-18(17-28)9-12-20)15-5-14-26-21-6-3-4-7-23(21)29-24-13-10-19(25)16-22(24)26/h3-4,6-13,16H,5,14-15,17H2,1-2H3