methyl 2,2-dimethyl-4-[4-[7-(oxan-2-yloxy)hept-2-ynoxy]phenyl]sulfonyl-thiomorpholine-3-carboxylate

Systemtic Name: methyl 2,2-dimethyl-4-[4-[7-(oxan-2-yloxy)hept-2-ynoxy]phenyl]sulfonyl-thiomorpholine-3-carboxylate Openeye Name: methyl 2,2-dimethyl-4-[4-(7-tetrahydropyran-2-yloxyhept-2-ynoxy)phenyl]sulfonyl-thiomorpholine-3-carboxylate CAS Name: 2,2-dimethyl-4-[4-[7-(2-oxanyloxy)hept-2-ynoxy]phenyl]sulfonyl-3-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-4-[4-[7-(oxan-2-yloxy)hept-2-ynoxy]phenyl]sulfonylthiomorpholine-3-carboxylate Traditional Name: 2,2-dimethyl-4-[4-(7-tetrahydropyran-2-yloxyhept-2-ynoxy)phenyl]sulfonyl-thiomorpholine-3-carboxylic acid methyl ester Formula: C26H37NO7S2 MolecularWeight: 539.70448

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)OCC#CCCCCOC3CCCCO3)C(=O)OC)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)OCC#CCCCCOC3CCCCO3)C(=O)OC)C

InChI

InChI=1S/C26H37NO7S2/c1-26(2)24(25(28)31-3)27(16-20-35-26)36(29,30)22-14-12-21(13-15-22)32-17-8-5-4-6-9-18-33-23-11-7-10-19-34-23/h12-15,23-24H,4,6-7,9-11,16-20H2,1-3H3