[3,5-bis(butoxycarbonyloxy)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-thian-4-yl] butyl carbonate

Systemtic Name: [3,5-bis(butoxycarbonyloxy)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-thian-4-yl] butyl carbonate Openeye Name: [3,5-bis(butoxycarbonyloxy)-2-(4-methyl-2-oxo-chromen-7-yl)oxy-tetrahydrothiopyran-4-yl] butyl carbonate CAS Name: carbonic acid [3,5-bis[butoxy(oxo)methoxy]-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-4-thianyl] butyl ester IUPAC Name: [3,5-bis(butoxycarbonyloxy)-2-(4-methyl-2-oxochromen-7-yl)oxythian-4-yl] butyl carbonate Traditional Name: carbonic acid [3,5-bis(butoxycarbonyloxy)-2-(2-keto-4-methyl-chromen-7-yl)oxy-tetrahydrothiopyran-4-yl] butyl ester Formula: C30H40O12S MolecularWeight: 624.6964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)OC1CSC(C(C1OC(=O)OCCCC)OC(=O)OCCCC)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CCCCOC(=O)OC1CSC(C(C1OC(=O)OCCCC)OC(=O)OCCCC)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C30H40O12S/c1-5-8-13-35-28(32)40-23-18-43-27(38-20-11-12-21-19(4)16-24(31)39-22(21)17-20)26(42-30(34)37-15-10-7-3)25(23)41-29(33)36-14-9-6-2/h11-12,16-17,23,25-27H,5-10,13-15,18H2,1-4H3