methyl (2R)-3-methyl-2-[[4-[6-(4-methylphenyl)sulfonyloxyhex-1-ynyl]phenyl]sulfonylamino]butanoate

Systemtic Name: methyl (2R)-3-methyl-2-[[4-[6-(4-methylphenyl)sulfonyloxyhex-1-ynyl]phenyl]sulfonylamino]butanoate Openeye Name: methyl (2R)-3-methyl-2-[[4-[6-(p-tolylsulfonyloxy)hex-1-ynyl]phenyl]sulfonylamino]butanoate CAS Name: (2R)-3-methyl-2-[[4-[6-(4-methylphenyl)sulfonyloxyhex-1-ynyl]phenyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3-methyl-2-[[4-[6-(4-methylphenyl)sulfonyloxyhex-1-ynyl]phenyl]sulfonylamino]butanoate Traditional Name: (2R)-3-methyl-2-[[4-(6-tosyloxyhex-1-ynyl)phenyl]sulfonylamino]butyric acid methyl ester Formula: C25H31NO7S2 MolecularWeight: 521.64614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCC#CC2=CC=C(C=C2)S(=O)(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCC#CC2=CC=C(C=C2)S(=O)(=O)N[C@H](C(C)C)C(=O)OC

InChI

InChI=1S/C25H31NO7S2/c1-19(2)24(25(27)32-4)26-34(28,29)22-16-12-21(13-17-22)9-7-5-6-8-18-33-35(30,31)23-14-10-20(3)11-15-23/h10-17,19,24,26H,5-6,8,18H2,1-4H3/t24-/m1/s1