azanylidyneazanium; 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; chloride

Systemtic Name: azanylidyneazanium; 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; chloride Openeye Name: 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; nitridoammonium; chloride CAS Name: 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; nitriloammonium; chloride IUPAC Name: azanylidyneazanium; 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; chloride Traditional Name: 1,4-dimethoxy-2-[4-(3-methylphenoxy)phenoxy]benzene; nitriloammonium; chloride Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)OC3=C(C=CC(=C3)OC)OC.[NH+]#N.[Cl-]

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)OC3=C(C=CC(=C3)OC)OC.[NH+]#N.[Cl-]

InChI

InChI=1S/C21H20O4.ClH.N2/c1-15-5-4-6-19(13-15)24-16-7-9-17(10-8-16)25-21-14-18(22-2)11-12-20(21)23-3;;1-2/h4-14H,1-3H3;1H;