butyl 2-[3-(4-sulfanylidenechromen-2-yl)phenyl]ethanoate

Systemtic Name: butyl 2-[3-(4-sulfanylidenechromen-2-yl)phenyl]ethanoate Openeye Name: butyl 2-[3-(4-thioxochromen-2-yl)phenyl]acetate CAS Name: 2-[3-(4-sulfanylidene-1-benzopyran-2-yl)phenyl]acetic acid butyl ester IUPAC Name: butyl 2-[3-(4-sulfanylidenechromen-2-yl)phenyl]acetate Traditional Name: 2-[3-(4-thioxochromen-2-yl)phenyl]acetic acid butyl ester Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1=CC=CC(=C1)C2=CC(=S)C3=CC=CC=C3O2

Isomeric SMILES

CCCCOC(=O)CC1=CC=CC(=C1)C2=CC(=S)C3=CC=CC=C3O2

InChI

InChI=1S/C21H20O3S/c1-2-3-11-23-21(22)13-15-7-6-8-16(12-15)19-14-20(25)17-9-4-5-10-18(17)24-19/h4-10,12,14H,2-3,11,13H2,1H3