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

Systemtic Name: 2-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[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=CC=C4C#N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

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