dibutyl-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: dibutyl-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: dibutyl-[2-(2-chlorophenothiazin-10-yl)-2-oxo-ethyl]ammonium CAS Name: dibutyl-[2-(2-chloro-10-phenothiazinyl)-2-oxoethyl]ammonium IUPAC Name: dibutyl-[2-(2-chlorophenothiazin-10-yl)-2-oxoethyl]azanium Traditional Name: dibutyl-[2-(2-chlorophenothiazin-10-yl)-2-keto-ethyl]ammonium Formula: C22H28ClN2OS+ MolecularWeight: 403.98852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CCCC[NH+](CCCC)CC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2OS/c1-3-5-13-24(14-6-4-2)16-22(26)25-18-9-7-8-10-20(18)27-21-12-11-17(23)15-19(21)25/h7-12,15H,3-6,13-14,16H2,1-2H3/p+1