methyl (5R)-5-[[(R)-(4-methylphenyl)sulfinyl]amino]-3-oxidanylidene-11-phenylmethoxy-undecanoate

Systemtic Name: methyl (5R)-5-[[(R)-(4-methylphenyl)sulfinyl]amino]-3-oxidanylidene-11-phenylmethoxy-undecanoate Openeye Name: methyl (5R)-11-benzyloxy-3-oxo-5-[[(R)-p-tolylsulfinyl]amino]undecanoate CAS Name: (5R)-5-[[(R)-(4-methylphenyl)sulfinyl]amino]-3-oxo-11-phenylmethoxyundecanoic acid methyl ester IUPAC Name: methyl (5R)-5-[[(R)-(4-methylphenyl)sulfinyl]amino]-3-oxo-11-phenylmethoxyundecanoate Traditional Name: (5R)-11-benzoxy-3-keto-5-[[(R)-p-tolylsulfinyl]amino]undecanoic acid methyl ester Formula: C26H35NO5S MolecularWeight: 473.6248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(CCCCCCOCC2=CC=CC=C2)CC(=O)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)N[C@H](CCCCCCOCC2=CC=CC=C2)CC(=O)CC(=O)OC

InChI

InChI=1S/C26H35NO5S/c1-21-13-15-25(16-14-21)33(30)27-23(18-24(28)19-26(29)31-2)12-8-3-4-9-17-32-20-22-10-6-5-7-11-22/h5-7,10-11,13-16,23,27H,3-4,8-9,12,17-20H2,1-2H3/t23-,33-/m1/s1