diethyl-[7-[(2-methylphenyl)amino]phenoxazin-3-ylidene]azanium; zinc; tetrachloride

Systemtic Name: diethyl-[7-[(2-methylphenyl)amino]phenoxazin-3-ylidene]azanium; zinc; tetrachloride Openeye Name: diethyl-[7-(2-methylanilino)phenoxazin-3-ylidene]ammonium; zinc; tetrachloride CAS Name: diethyl-[7-(2-methylanilino)-3-phenoxazinylidene]ammonium; zinc; tetrachloride IUPAC Name: diethyl-[7-(2-methylanilino)phenoxazin-3-ylidene]azanium; zinc; tetrachloride Traditional Name: diethyl-[7-(o-toluidino)phenoxazin-3-ylidene]ammonium; zinc; tetrachloride Formula: C46H48Cl4N6O2Zn-2 MolecularWeight: 924.13332

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1C=CC2=NC3=C(C=C(C=C3)NC4=CC=CC=C4C)OC2=C1)CC.CC[N+](=C1C=CC2=NC3=C(C=C(C=C3)NC4=CC=CC=C4C)OC2=C1)CC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn]

Isomeric SMILES

CC[N+](=C1C=CC2=NC3=C(C=C(C=C3)NC4=CC=CC=C4C)OC2=C1)CC.CC[N+](=C1C=CC2=NC3=C(C=C(C=C3)NC4=CC=CC=C4C)OC2=C1)CC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn]

InChI

InChI=1S/2C23H23N3O.4ClH.Zn/c2*1-4-26(5-2)18-11-13-21-23(15-18)27-22-14-17(10-12-20(22)25-21)24-19-9-7-6-8-16(19)3;;;;;/h2*6-15H,4-5H2,1-3H3;4*1H;/p-2