(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H21ClN2O6S MolecularWeight: 476.92994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C22H21ClN2O6S/c1-29-18-6-5-15-11-17(21(23)24-20(15)13-18)14-31-22(26)16-3-2-4-19(12-16)32(27,28)25-7-9-30-10-8-25/h2-6,11-13H,7-10,14H2,1H3