ethyl 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]acetate CAS Name: 2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]acetate Traditional Name: 2-[(3-ketobenzo[f]chromen-1-yl)methylthio]acetic acid ethyl ester Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)CSCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C18H16O4S/c1-2-21-17(20)11-23-10-13-9-16(19)22-15-8-7-12-5-3-4-6-14(12)18(13)15/h3-9H,2,10-11H2,1H3