6,7-dimethoxy-2-[(4-methoxyphenyl)methyl]-3-[(6-prop-2-enyl-1,3-benzodioxol-5-yl)methyl]-3H-isoindol-1-one

Systemtic Name: 6,7-dimethoxy-2-[(4-methoxyphenyl)methyl]-3-[(6-prop-2-enyl-1,3-benzodioxol-5-yl)methyl]-3H-isoindol-1-one Openeye Name: 3-[(6-allyl-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-2-[(4-methoxyphenyl)methyl]isoindolin-1-one CAS Name: 6,7-dimethoxy-2-[(4-methoxyphenyl)methyl]-3-[(6-prop-2-enyl-1,3-benzodioxol-5-yl)methyl]-3H-isoindol-1-one IUPAC Name: 6,7-dimethoxy-2-[(4-methoxyphenyl)methyl]-3-[(6-prop-2-enyl-1,3-benzodioxol-5-yl)methyl]-3H-isoindol-1-one Traditional Name: 3-[(6-allyl-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-2-p-anisyl-isoindolin-1-one Formula: C29H29NO6 MolecularWeight: 487.54366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(C3=C(C2=O)C(=C(C=C3)OC)OC)CC4=CC5=C(C=C4CC=C)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(C3=C(C2=O)C(=C(C=C3)OC)OC)CC4=CC5=C(C=C4CC=C)OCO5

InChI

InChI=1S/C29H29NO6/c1-5-6-19-14-25-26(36-17-35-25)15-20(19)13-23-22-11-12-24(33-3)28(34-4)27(22)29(31)30(23)16-18-7-9-21(32-2)10-8-18/h5,7-12,14-15,23H,1,6,13,16-17H2,2-4H3