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

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-thiophen-3-ylpropanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-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=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)CCC4=CSC=C4

InChI

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