(3-methyl-4-propan-2-yl-phenyl) 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (4-isopropyl-3-methyl-phenyl) 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (4-isopropyl-3-methyl-phenyl) ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C(C)C

InChI

InChI=1S/C21H25NO5S/c1-15(2)20-8-7-18(13-16(20)3)27-21(23)17-5-4-6-19(14-17)28(24,25)22-9-11-26-12-10-22/h4-8,13-15H,9-12H2,1-3H3