4-[(3-methoxyphenyl)methoxy]-2,6-dimethyl-2-(phenylsulfonyl)morpholine-3-carboxylic acid

Systemtic Name: 4-[(3-methoxyphenyl)methoxy]-2,6-dimethyl-2-(phenylsulfonyl)morpholine-3-carboxylic acid Openeye Name: 2-(benzenesulfonyl)-4-[(3-methoxyphenyl)methoxy]-2,6-dimethyl-morpholine-3-carboxylic acid CAS Name: 2-(benzenesulfonyl)-4-[(3-methoxyphenyl)methoxy]-2,6-dimethyl-3-morpholinecarboxylic acid IUPAC Name: 2-(benzenesulfonyl)-4-[(3-methoxyphenyl)methoxy]-2,6-dimethylmorpholine-3-carboxylic acid Traditional Name: 2-besyl-4-m-anisyloxy-2,6-dimethyl-morpholine-3-carboxylic acid Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C(O1)(C)S(=O)(=O)C2=CC=CC=C2)C(=O)O)OCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1CN(C(C(O1)(C)S(=O)(=O)C2=CC=CC=C2)C(=O)O)OCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H25NO7S/c1-15-13-22(28-14-16-8-7-9-17(12-16)27-3)19(20(23)24)21(2,29-15)30(25,26)18-10-5-4-6-11-18/h4-12,15,19H,13-14H2,1-3H3,(H,23,24)