[2-methyl-4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] thiophene-2-carboxylate

Systemtic Name: [2-methyl-4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] thiophene-2-carboxylate Openeye Name: [2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-methyl-4-oxo-3-[4-[oxo(propoxy)methyl]phenoxy]-1-benzopyran-7-yl] ester IUPAC Name: [2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-keto-2-methyl-3-(4-propoxycarbonylphenoxy)chromen-7-yl] ester Formula: C25H20O7S MolecularWeight: 464.4871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CS4)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CS4)C

InChI

InChI=1S/C25H20O7S/c1-3-12-29-24(27)16-6-8-17(9-7-16)31-23-15(2)30-20-14-18(10-11-19(20)22(23)26)32-25(28)21-5-4-13-33-21/h4-11,13-14H,3,12H2,1-2H3