(3S)-2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-4,5,6,7-tetrahydro-3H-isoindol-1-one

Systemtic Name: (3S)-2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-4,5,6,7-tetrahydro-3H-isoindol-1-one Openeye Name: (3S)-2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-4,5,6,7-tetrahydro-3H-isoindol-1-one CAS Name: (3S)-2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-4,5,6,7-tetrahydro-3H-isoindol-1-one IUPAC Name: (3S)-2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-4,5,6,7-tetrahydro-3H-isoindol-1-one Traditional Name: (3S)-3-methoxy-2-piperonyl-4,5,6,7-tetrahydro-3H-isoindol-1-one Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2=C(CCCC2)C(=O)N1CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CO[C@H]1C2=C(CCCC2)C(=O)N1CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19NO4/c1-20-17-13-5-3-2-4-12(13)16(19)18(17)9-11-6-7-14-15(8-11)22-10-21-14/h6-8,17H,2-5,9-10H2,1H3/t17-/m0/s1