tert-butyl 2-[3-(hydroxymethyl)-6-methoxy-1-oxidanylidene-isochromen-8-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[3-(hydroxymethyl)-6-methoxy-1-oxidanylidene-isochromen-8-yl]oxyethanoate Openeye Name: tert-butyl 2-[3-(hydroxymethyl)-6-methoxy-1-oxo-isochromen-8-yl]oxyacetate CAS Name: 2-[[3-(hydroxymethyl)-6-methoxy-1-oxo-2-benzopyran-8-yl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(hydroxymethyl)-6-methoxy-1-oxoisochromen-8-yl]oxyacetate Traditional Name: 2-(1-keto-6-methoxy-3-methylol-isochromen-8-yl)oxyacetic acid tert-butyl ester Formula: C17H20O7 MolecularWeight: 336.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=C2C(=CC(=C1)OC)C=C(OC2=O)CO

Isomeric SMILES

CC(C)(C)OC(=O)COC1=C2C(=CC(=C1)OC)C=C(OC2=O)CO

InChI

InChI=1S/C17H20O7/c1-17(2,3)24-14(19)9-22-13-7-11(21-4)5-10-6-12(8-18)23-16(20)15(10)13/h5-7,18H,8-9H2,1-4H3