2-methyl-6-[2-(methylamino)-2-oxidanylidene-ethyl]-4-(4-phenylmethoxyphenyl)sulfonyl-morpholine-3-carboxylic acid

Systemtic Name: 2-methyl-6-[2-(methylamino)-2-oxidanylidene-ethyl]-4-(4-phenylmethoxyphenyl)sulfonyl-morpholine-3-carboxylic acid Openeye Name: 4-(4-benzyloxyphenyl)sulfonyl-2-methyl-6-[2-(methylamino)-2-oxo-ethyl]morpholine-3-carboxylic acid CAS Name: 2-methyl-6-[2-(methylamino)-2-oxoethyl]-4-(4-phenylmethoxyphenyl)sulfonyl-3-morpholinecarboxylic acid IUPAC Name: 2-methyl-6-[2-(methylamino)-2-oxoethyl]-4-(4-phenylmethoxyphenyl)sulfonylmorpholine-3-carboxylic acid Traditional Name: 4-(4-benzoxyphenyl)sulfonyl-6-[2-keto-2-(methylamino)ethyl]-2-methyl-morpholine-3-carboxylic acid Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CC(O1)CC(=O)NC)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1C(N(CC(O1)CC(=O)NC)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H26N2O7S/c1-15-21(22(26)27)24(13-18(31-15)12-20(25)23-2)32(28,29)19-10-8-17(9-11-19)30-14-16-6-4-3-5-7-16/h3-11,15,18,21H,12-14H2,1-2H3,(H,23,25)(H,26,27)