4-(4-hex-4-yn-3-yloxyphenyl)sulfonyl-2,6-dimethyl-morpholine-3-carboxylic acid

Systemtic Name: 4-(4-hex-4-yn-3-yloxyphenyl)sulfonyl-2,6-dimethyl-morpholine-3-carboxylic acid Openeye Name: 4-[4-(1-ethylbut-2-ynoxy)phenyl]sulfonyl-2,6-dimethyl-morpholine-3-carboxylic acid CAS Name: 4-(4-hex-4-yn-3-yloxyphenyl)sulfonyl-2,6-dimethyl-3-morpholinecarboxylic acid IUPAC Name: 4-(4-hex-4-yn-3-yloxyphenyl)sulfonyl-2,6-dimethylmorpholine-3-carboxylic acid Traditional Name: 4-[4-(1-ethylbut-2-ynoxy)phenyl]sulfonyl-2,6-dimethyl-morpholine-3-carboxylic acid Formula: C19H25NO6S MolecularWeight: 395.4699

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC)OC1=CC=C(C=C1)S(=O)(=O)N2CC(OC(C2C(=O)O)C)C

Isomeric SMILES

CCC(C#CC)OC1=CC=C(C=C1)S(=O)(=O)N2CC(OC(C2C(=O)O)C)C

InChI

InChI=1S/C19H25NO6S/c1-5-7-15(6-2)26-16-8-10-17(11-9-16)27(23,24)20-12-13(3)25-14(4)18(20)19(21)22/h8-11,13-15,18H,6,12H2,1-4H3,(H,21,22)