3-[2-oxidanylidene-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-[2-oxidanylidene-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 3-[2-oxo-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethoxy]benzonitrile CAS Name: 3-[2-oxo-2-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethoxy]benzonitrile IUPAC Name: 3-[2-oxo-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethoxy]benzonitrile Traditional Name: 3-[2-keto-2-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethoxy]benzonitrile Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)COC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)COC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H23N3O4S/c23-15-17-5-3-7-19(13-17)29-16-22(26)25-12-4-6-18-14-20(8-9-21(18)25)30(27,28)24-10-1-2-11-24/h3,5,7-9,13-14H,1-2,4,6,10-12,16H2