2-[[2-cyclohexyl-3-(4-methylphenyl)sulfonyloxy-propyl]-phenylmethoxycarbonyl-amino]ethanoic acid

Systemtic Name: 2-[[2-cyclohexyl-3-(4-methylphenyl)sulfonyloxy-propyl]-phenylmethoxycarbonyl-amino]ethanoic acid Openeye Name: 2-[benzyloxycarbonyl-[2-cyclohexyl-3-(p-tolylsulfonyloxy)propyl]amino]acetic acid CAS Name: 2-[[2-cyclohexyl-3-(4-methylphenyl)sulfonyloxypropyl]-phenylmethoxycarbonylamino]acetic acid IUPAC Name: 2-[[2-cyclohexyl-3-(4-methylphenyl)sulfonyloxypropyl]-phenylmethoxycarbonylamino]acetic acid Traditional Name: 2-[carbobenzoxy-(2-cyclohexyl-3-tosyloxy-propyl)amino]acetic acid Formula: C26H33NO7S MolecularWeight: 503.60772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CN(CC(=O)O)C(=O)OCC2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CN(CC(=O)O)C(=O)OCC2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C26H33NO7S/c1-20-12-14-24(15-13-20)35(31,32)34-19-23(22-10-6-3-7-11-22)16-27(17-25(28)29)26(30)33-18-21-8-4-2-5-9-21/h2,4-5,8-9,12-15,22-23H,3,6-7,10-11,16-19H2,1H3,(H,28,29)