[3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] methanesulfonate

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] methanesulfonate Openeye Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-chromen-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxochromen-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-(1,3-benzodioxol-5-yl)-2-keto-4-methyl-chromen-6-yl] ester Formula: C18H14O7S MolecularWeight: 374.36456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OS(=O)(=O)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OS(=O)(=O)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14O7S/c1-10-13-8-12(25-26(2,20)21)4-6-14(13)24-18(19)17(10)11-3-5-15-16(7-11)23-9-22-15/h3-8H,9H2,1-2H3