6,7-dimethoxy-3-(3-oxidanylpropyl)isochromen-1-one

Systemtic Name: 6,7-dimethoxy-3-(3-oxidanylpropyl)isochromen-1-one Openeye Name: 3-(3-hydroxypropyl)-6,7-dimethoxy-isochromen-1-one CAS Name: 3-(3-hydroxypropyl)-6,7-dimethoxy-2-benzopyran-1-one IUPAC Name: 3-(3-hydroxypropyl)-6,7-dimethoxyisochromen-1-one Traditional Name: 3-(3-hydroxypropyl)-6,7-dimethoxy-isocoumarin Formula: C14H16O5 MolecularWeight: 264.27384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(OC2=O)CCCO)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(OC2=O)CCCO)OC

InChI

InChI=1S/C14H16O5/c1-17-12-7-9-6-10(4-3-5-15)19-14(16)11(9)8-13(12)18-2/h6-8,15H,3-5H2,1-2H3