(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-thiophen-2-ylpropanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-thiophen-2-ylpropanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C21H16O4S MolecularWeight: 364.41434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)CCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)CCC4=CC=CS4

InChI

InChI=1S/C21H16O4S/c22-19(10-8-16-5-3-11-26-16)24-13-15-12-20(23)25-18-9-7-14-4-1-2-6-17(14)21(15)18/h1-7,9,11-12H,8,10,13H2