1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-1-pyrrolidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenylpyrrolidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidino]methanone Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3CN(CC3C4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3CN(CC3C4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H28N2O3/c31-28(22-10-11-26-27(14-22)33-19-32-26)30-17-24(25(18-30)21-7-2-1-3-8-21)16-29-13-12-20-6-4-5-9-23(20)15-29/h1-11,14,24-25H,12-13,15-19H2