(1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene

Systemtic Name: (1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene Openeye Name: (1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-isochromane CAS Name: (1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran IUPAC Name: (1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene Traditional Name: (1S)-1-(bromomethyl)-1-(4-chlorophenyl)-6,7-dimethoxy-isochroman Formula: C18H18BrClO3 MolecularWeight: 397.69072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCOC2(CBr)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCO[C@@]2(CBr)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C18H18BrClO3/c1-21-16-9-12-7-8-23-18(11-19,15(12)10-17(16)22-2)13-3-5-14(20)6-4-13/h3-6,9-10H,7-8,11H2,1-2H3/t18-/m0/s1