1-(4-bromophenyl)-6,7-diethoxy-1,4-dihydroisochromen-3-one

Systemtic Name: 1-(4-bromophenyl)-6,7-diethoxy-1,4-dihydroisochromen-3-one Openeye Name: 1-(4-bromophenyl)-6,7-diethoxy-isochroman-3-one CAS Name: 1-(4-bromophenyl)-6,7-diethoxy-3,4-dihydro-1H-2-benzopyran-3-one IUPAC Name: 1-(4-bromophenyl)-6,7-diethoxy-1,4-dihydroisochromen-3-one Traditional Name: 1-(4-bromophenyl)-6,7-diethoxy-isochroman-3-one Formula: C19H19BrO4 MolecularWeight: 391.25576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(OC(=O)CC2=C1)C3=CC=C(C=C3)Br)OCC

Isomeric SMILES

CCOC1=C(C=C2C(OC(=O)CC2=C1)C3=CC=C(C=C3)Br)OCC

InChI

InChI=1S/C19H19BrO4/c1-3-22-16-9-13-10-18(21)24-19(12-5-7-14(20)8-6-12)15(13)11-17(16)23-4-2/h5-9,11,19H,3-4,10H2,1-2H3