methyl 5-(4-methylphenyl)sulfonyloxy-4-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: methyl 5-(4-methylphenyl)sulfonyloxy-4-(phenylmethoxycarbonylamino)pentanoate Openeye Name: methyl 4-(benzyloxycarbonylamino)-5-(p-tolylsulfonyloxy)pentanoate CAS Name: 5-(4-methylphenyl)sulfonyloxy-4-(phenylmethoxycarbonylamino)pentanoic acid methyl ester IUPAC Name: methyl 5-(4-methylphenyl)sulfonyloxy-4-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 4-(benzyloxycarbonylamino)-5-tosyloxy-valeric acid methyl ester Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCC(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCC(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO7S/c1-16-8-11-19(12-9-16)30(25,26)29-15-18(10-13-20(23)27-2)22-21(24)28-14-17-6-4-3-5-7-17/h3-9,11-12,18H,10,13-15H2,1-2H3,(H,22,24)