(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-thiophen-3-ylpropanoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-thiophen-3-ylpropanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C19H18O4S MolecularWeight: 342.40882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CSC=C3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CSC=C3)C

InChI

InChI=1S/C19H18O4S/c1-12-3-5-16-15(9-18(21)23-19(16)13(12)2)10-22-17(20)6-4-14-7-8-24-11-14/h3,5,7-9,11H,4,6,10H2,1-2H3