(2-chloranylquinolin-3-yl)methyl 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-methoxy-3-morpholinosulfonyl-benzoate CAS Name: 4-methoxy-3-(4-morpholinylsulfonyl)benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-methoxy-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-morpholinosulfonyl-benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C22H21ClN2O6S MolecularWeight: 476.92994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl)S(=O)(=O)N4CCOCC4

InChI

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