2-(2-naphthalen-2-ylsulfonyl-4-phenylmethoxy-pyrrolidin-2-yl)ethanenitrile

Systemtic Name: 2-(2-naphthalen-2-ylsulfonyl-4-phenylmethoxy-pyrrolidin-2-yl)ethanenitrile Openeye Name: 2-[4-benzyloxy-2-(2-naphthylsulfonyl)pyrrolidin-2-yl]acetonitrile CAS Name: 2-[2-(2-naphthalenylsulfonyl)-4-phenylmethoxy-2-pyrrolidinyl]acetonitrile IUPAC Name: 2-(2-naphthalen-2-ylsulfonyl-4-phenylmethoxypyrrolidin-2-yl)acetonitrile Traditional Name: 2-[4-benzoxy-2-(2-naphthylsulfonyl)pyrrolidin-2-yl]acetonitrile Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1(CC#N)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CNC1(CC#N)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)OCC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O3S/c24-13-12-23(15-21(16-25-23)28-17-18-6-2-1-3-7-18)29(26,27)22-11-10-19-8-4-5-9-20(19)14-22/h1-11,14,21,25H,12,15-17H2