methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-6-phenylmethoxy-hexanoate

Systemtic Name: methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-6-phenylmethoxy-hexanoate Openeye Name: methyl (2S)-6-benzyloxy-2-(p-tolylsulfonylamino)hexanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-6-phenylmethoxyhexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-6-phenylmethoxyhexanoate Traditional Name: (2S)-6-benzoxy-2-(tosylamino)hexanoic acid methyl ester Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCOCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCCCOCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H27NO5S/c1-17-11-13-19(14-12-17)28(24,25)22-20(21(23)26-2)10-6-7-15-27-16-18-8-4-3-5-9-18/h3-5,8-9,11-14,20,22H,6-7,10,15-16H2,1-2H3/t20-/m0/s1