4-[3-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)phenyl]sulfonylpiperazin-2-one

Systemtic Name: 4-[3-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)phenyl]sulfonylpiperazin-2-one Openeye Name: 4-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]sulfonylpiperazin-2-one CAS Name: 4-[3-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]phenyl]sulfonyl-2-piperazinone IUPAC Name: 4-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]sulfonylpiperazin-2-one Traditional Name: 4-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]sulfonylpiperazin-2-one Formula: C20H21N3O4S MolecularWeight: 399.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C20H21N3O4S/c24-19-14-22(12-10-21-19)28(26,27)17-8-3-6-16(13-17)20(25)23-11-4-7-15-5-1-2-9-18(15)23/h1-3,5-6,8-9,13H,4,7,10-12,14H2,(H,21,24)