[2-[[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]amino]-2-oxidanylidene-ethyl] 2,2-dimethylpropanoate

Systemtic Name: [2-[[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]amino]-2-oxidanylidene-ethyl] 2,2-dimethylpropanoate Openeye Name: [2-oxo-2-[[1-(p-tolylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]amino]ethyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-[[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]amino]-2-oxoethyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-keto-2-[(1-tosyl-3,4-dihydro-2H-quinolin-7-yl)amino]ethyl] ester Formula: C23H28N2O5S MolecularWeight: 444.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O5S/c1-16-7-11-19(12-8-16)31(28,29)25-13-5-6-17-9-10-18(14-20(17)25)24-21(26)15-30-22(27)23(2,3)4/h7-12,14H,5-6,13,15H2,1-4H3,(H,24,26)