2-[(Z)-2-phenoxathiin-4-ylethenyl]anthracene-9,10-dione

Systemtic Name: 2-[(Z)-2-phenoxathiin-4-ylethenyl]anthracene-9,10-dione Openeye Name: 2-[(Z)-2-phenoxathiin-4-ylvinyl]anthracene-9,10-dione CAS Name: 2-[(Z)-2-(4-phenoxathiinyl)ethenyl]anthracene-9,10-dione IUPAC Name: 2-[(Z)-2-phenoxathiin-4-ylethenyl]anthracene-9,10-dione Traditional Name: 2-[(Z)-2-phenoxathiin-4-ylvinyl]-9,10-anthraquinone Formula: C28H16O3S MolecularWeight: 432.48984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C=CC4=C5C(=CC=C4)SC6=CC=CC=C6O5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)/C=C\C4=C5C(=CC=C4)SC6=CC=CC=C6O5

InChI

InChI=1S/C28H16O3S/c29-26-19-7-1-2-8-20(19)27(30)22-16-17(13-15-21(22)26)12-14-18-6-5-11-25-28(18)31-23-9-3-4-10-24(23)32-25/h1-16H/b14-12-