ethyl 4-[4-[(8-methylquinolin-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(8-methylquinolin-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[(8-methyl-5-quinolyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[(8-methyl-5-quinolinyl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(8-methylquinolin-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[(8-methyl-5-quinolyl)carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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)NC3=C4C=CC=NC4=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C4C=CC=NC4=C(C=C3)C

InChI

InChI=1S/C25H27N3O5S/c1-3-33-25(30)19-7-9-20(10-8-19)34(31,32)28-15-12-18(13-16-28)24(29)27-22-11-6-17(2)23-21(22)5-4-14-26-23/h4-11,14,18H,3,12-13,15-16H2,1-2H3,(H,27,29)