4-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidino]sulfonylbenzonitrile Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H23N3O3S/c23-16-17-7-9-20(10-8-17)29(27,28)24-14-11-19(12-15-24)22(26)25-13-3-5-18-4-1-2-6-21(18)25/h1-2,4,6-10,19H,3,5,11-15H2