(4-morpholin-4-ylsulfonylphenyl) 4-(3-methylphenoxy)butanoate

Systemtic Name: (4-morpholin-4-ylsulfonylphenyl) 4-(3-methylphenoxy)butanoate Openeye Name: (4-morpholinosulfonylphenyl) 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid [4-(4-morpholinylsulfonyl)phenyl] ester IUPAC Name: (4-morpholin-4-ylsulfonylphenyl) 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid (4-morpholinosulfonylphenyl) ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)OC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)OC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25NO6S/c1-17-4-2-5-19(16-17)27-13-3-6-21(23)28-18-7-9-20(10-8-18)29(24,25)22-11-14-26-15-12-22/h2,4-5,7-10,16H,3,6,11-15H2,1H3