N-(3-methylbutyl)-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-isopentyl-1-(p-tolylsulfonyl)-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(3-methylbutyl)-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(3-methylbutyl)-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-isoamyl-1-tosyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)C(=O)NCCC(C)C

InChI

InChI=1S/C22H28N2O3S/c1-16(2)12-13-23-22(25)19-8-11-21-18(15-19)5-4-14-24(21)28(26,27)20-9-6-17(3)7-10-20/h6-11,15-16H,4-5,12-14H2,1-3H3,(H,23,25)