2-phenyl-4-[(E)-phenyl(thiochromen-4-ylidene)methyl]chromenylium

Systemtic Name: 2-phenyl-4-[(E)-phenyl(thiochromen-4-ylidene)methyl]chromenylium Openeye Name: 2-phenyl-4-[(E)-phenyl(thiochromen-4-ylidene)methyl]chromenylium CAS Name: 4-[(E)-1-benzothiopyran-4-ylidene(phenyl)methyl]-2-phenyl-1-benzopyrylium IUPAC Name: 2-phenyl-4-[(E)-phenyl(thiochromen-4-ylidene)methyl]chromenylium Traditional Name: 2-phenyl-4-[(E)-phenyl(thiochromen-4-ylidene)methyl]-1-benzopyrylium Formula: C31H21OS+ MolecularWeight: 441.56284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C(=C2)C(=C4C=CSC5=CC=CC=C45)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C(=C2)/C(=C/4\C=CSC5=CC=CC=C45)/C6=CC=CC=C6

InChI

InChI=1S/C31H21OS/c1-3-11-22(12-4-1)29-21-27(24-15-7-9-17-28(24)32-29)31(23-13-5-2-6-14-23)26-19-20-33-30-18-10-8-16-25(26)30/h1-21H/q+1/b31-26+