methyl 4-[[4-[(4-oxidanylidenethiochromen-3-ylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(4-oxidanylidenethiochromen-3-ylidene)methyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(4-oxothiochroman-3-ylidene)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(4-oxo-1-benzothiopyran-3-ylidene)methyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(4-oxothiochromen-3-ylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(4-ketothiochroman-3-ylidene)methyl]phenoxy]methyl]benzoic acid methyl ester Formula: C25H20O4S MolecularWeight: 416.4889

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C3CSC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C3CSC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H20O4S/c1-28-25(27)19-10-6-18(7-11-19)15-29-21-12-8-17(9-13-21)14-20-16-30-23-5-3-2-4-22(23)24(20)26/h2-14H,15-16H2,1H3