2-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: 2-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-6-(tert-butoxycarbonylamino)-2-chloro-hexanoic acid CAS Name: 2-chloro-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: 2-chloro-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-6-(tert-butoxycarbonylamino)-2-chloro-hexanoic acid Formula: C19H27ClN2O6 MolecularWeight: 414.88048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(C(=O)O)(NC(=O)OCC1=CC=CC=C1)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC(C(=O)O)(NC(=O)OCC1=CC=CC=C1)Cl

InChI

InChI=1S/C19H27ClN2O6/c1-18(2,3)28-16(25)21-12-8-7-11-19(20,15(23)24)22-17(26)27-13-14-9-5-4-6-10-14/h4-6,9-10H,7-8,11-13H2,1-3H3,(H,21,25)(H,22,26)(H,23,24)