1-[4-[(1R)-6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl]phenyl]pyrrolidine

Systemtic Name: 1-[4-[(1R)-6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl]phenyl]pyrrolidine Openeye Name: 1-[4-[(1R)-6,7-dimethoxyisochroman-1-yl]phenyl]pyrrolidine CAS Name: 1-[4-[(1R)-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl]phenyl]pyrrolidine IUPAC Name: 1-[4-[(1R)-6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl]phenyl]pyrrolidine Traditional Name: 1-[4-[(1R)-6,7-dimethoxyisochroman-1-yl]phenyl]pyrrolidine Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)C3=CC=C(C=C3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](OCCC2=C1)C3=CC=C(C=C3)N4CCCC4)OC

InChI

InChI=1S/C21H25NO3/c1-23-19-13-16-9-12-25-21(18(16)14-20(19)24-2)15-5-7-17(8-6-15)22-10-3-4-11-22/h5-8,13-14,21H,3-4,9-12H2,1-2H3/t21-/m1/s1