(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 5-chloranylthiophene-2-carboxylate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 5-chloranylthiophene-2-carboxylate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 5-chlorothiophene-2-carboxylate CAS Name: 5-chloro-2-thiophenecarboxylic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 5-chlorothiophene-2-carboxylate Traditional Name: 5-chlorothiophene-2-carboxylic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C17H13ClO5S MolecularWeight: 364.80012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)Cl)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)Cl)O

InChI

InChI=1S/C17H13ClO5S/c1-2-9-5-11-10(6-16(20)23-13(11)7-12(9)19)8-22-17(21)14-3-4-15(18)24-14/h3-7,19H,2,8H2,1H3