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

Systemtic Name: ethyl 4-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C24H28N2O5S MolecularWeight: 456.55452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C24H28N2O5S/c1-2-31-24(28)20-9-11-21(12-10-20)32(29,30)25-16-13-19(14-17-25)23(27)26-15-5-7-18-6-3-4-8-22(18)26/h3-4,6,8-12,19H,2,5,7,13-17H2,1H3