[4-chloranyl-2-(phenylmethyl)phenyl] 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [4-chloranyl-2-(phenylmethyl)phenyl] 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-benzyl-4-chloro-phenyl) 2-methoxy-5-morpholinosulfonyl-benzoate CAS Name: 2-methoxy-5-(4-morpholinylsulfonyl)benzoic acid [4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-4-chlorophenyl) 2-methoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methoxy-5-morpholinosulfonyl-benzoic acid (2-benzyl-4-chloro-phenyl) ester Formula: C25H24ClNO6S MolecularWeight: 501.97916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=C(C=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=C(C=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C25H24ClNO6S/c1-31-24-10-8-21(34(29,30)27-11-13-32-14-12-27)17-22(24)25(28)33-23-9-7-20(26)16-19(23)15-18-5-3-2-4-6-18/h2-10,16-17H,11-15H2,1H3