(3-morpholin-4-ylsulfonylphenyl)methyl 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-chloro-4-isobutoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-chloro-4-isobutoxy-5-methoxy-benzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C23H28ClNO7S MolecularWeight: 497.98892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC

InChI

InChI=1S/C23H28ClNO7S/c1-16(2)14-31-22-20(24)12-18(13-21(22)29-3)23(26)32-15-17-5-4-6-19(11-17)33(27,28)25-7-9-30-10-8-25/h4-6,11-13,16H,7-10,14-15H2,1-3H3