3-(1,3-benzodioxol-5-yl)-1-[2-(4-methylphenyl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-methylphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(p-tolyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-methylphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-methylphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(p-tolyl)pyrrolidino]propan-1-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23NO3/c1-15-4-8-17(9-5-15)18-3-2-12-22(18)21(23)11-7-16-6-10-19-20(13-16)25-14-24-19/h4-6,8-10,13,18H,2-3,7,11-12,14H2,1H3