N-[3-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[3-(1,3-benzodioxole-5-carbonylamino)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[3-(1,3-benzodioxole-5-carbonylamino)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-[3-(piperonyloylamino)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C25H23N3O6S MolecularWeight: 493.53162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H23N3O6S/c1-35(31,32)28-11-3-4-16-12-17(7-9-21(16)28)24(29)26-19-5-2-6-20(14-19)27-25(30)18-8-10-22-23(13-18)34-15-33-22/h2,5-10,12-14H,3-4,11,15H2,1H3,(H,26,29)(H,27,30)