(2-methylquinolin-8-yl) 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (2-methylquinolin-8-yl) 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzoate Openeye Name: (2-methyl-8-quinolyl) 5-morpholinosulfonyl-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)benzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-pyrrolidino-benzoic acid (2-methyl-8-quinolyl) ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5)C=C1

InChI

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