(6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylidene]-2,5-dimethyl-5-phenyl-cyclohexen-1-yl]methylidene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole

Systemtic Name: (6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylidene]-2,5-dimethyl-5-phenyl-cyclohexen-1-yl]methylidene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole Openeye Name: (6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylene]-2,5-dimethyl-5-phenyl-cyclohexen-1-yl]methylene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole CAS Name: (6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylidene]-2,5-dimethyl-5-phenyl-1-cyclohexenyl]methylidene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole IUPAC Name: (6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylidene]-2,5-dimethyl-5-phenylcyclohexen-1-yl]methylidene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole Traditional Name: (6E)-7-ethyl-6-[[(3Z)-3-[(7-ethyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium-6-yl)methylene]-2,5-dimethyl-5-phenyl-cyclohexen-1-yl]methylene]-[1,3]dioxolo[4,5-f][1,3]benzothiazole Formula: C36H35N2O4S2+ MolecularWeight: 623.8041

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC3=C(C=C2SC1=CC4=C(C(=CC5=[N+](C6=CC7=C(C=C6S5)OCO7)CC)CC(C4)(C)C8=CC=CC=C8)C)OCO3

Isomeric SMILES

CCN\1C2=CC3=C(C=C2S/C1=C/C4=C(/C(=C\C5=[N+](C6=CC7=C(C=C6S5)OCO7)CC)/CC(C4)(C)C8=CC=CC=C8)C)OCO3

InChI

InChI=1S/C36H35N2O4S2/c1-5-37-26-14-28-30(41-20-39-28)16-32(26)43-34(37)12-23-18-36(4,25-10-8-7-9-11-25)19-24(22(23)3)13-35-38(6-2)27-15-29-31(42-21-40-29)17-33(27)44-35/h7-17H,5-6,18-21H2,1-4H3/q+1