3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[(2R)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidino]sulfonylbenzonitrile Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2S(=O)(=O)C3=CC=CC(=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CCCN2S(=O)(=O)C3=CC=CC(=C3)C#N)OC

InChI

InChI=1S/C19H20N2O4S/c1-24-18-9-8-15(12-19(18)25-2)17-7-4-10-21(17)26(22,23)16-6-3-5-14(11-16)13-20/h3,5-6,8-9,11-12,17H,4,7,10H2,1-2H3/t17-/m1/s1