(3R,4S)-4-bromanyl-8-methoxy-3-(4-methoxyphenyl)-3,4-dihydroisochromen-1-one

Systemtic Name: (3R,4S)-4-bromanyl-8-methoxy-3-(4-methoxyphenyl)-3,4-dihydroisochromen-1-one Openeye Name: (3R,4S)-4-bromo-8-methoxy-3-(4-methoxyphenyl)isochroman-1-one CAS Name: (3R,4S)-4-bromo-8-methoxy-3-(4-methoxyphenyl)-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R,4S)-4-bromo-8-methoxy-3-(4-methoxyphenyl)-3,4-dihydroisochromen-1-one Traditional Name: (3R,4S)-4-bromo-8-methoxy-3-(4-methoxyphenyl)isochroman-1-one Formula: C17H15BrO4 MolecularWeight: 363.2026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=C(C(=CC=C3)OC)C(=O)O2)Br

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](C3=C(C(=CC=C3)OC)C(=O)O2)Br

InChI

InChI=1S/C17H15BrO4/c1-20-11-8-6-10(7-9-11)16-15(18)12-4-3-5-13(21-2)14(12)17(19)22-16/h3-9,15-16H,1-2H3/t15-,16+/m0/s1