(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxidanylidene-8-(phenylmethoxyamino)octanoic acid

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxidanylidene-8-(phenylmethoxyamino)octanoic acid Openeye Name: (2S)-8-(benzyloxyamino)-2-(tert-butoxycarbonylamino)-8-oxo-octanoic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-8-oxo-8-(phenylmethoxyamino)octanoic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxo-8-(phenylmethoxyamino)octanoic acid Traditional Name: (2S)-8-(benzoxyamino)-2-(tert-butoxycarbonylamino)-8-keto-caprylic acid Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCCC(=O)NOCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCCCC(=O)NOCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C20H30N2O6/c1-20(2,3)28-19(26)21-16(18(24)25)12-8-5-9-13-17(23)22-27-14-15-10-6-4-7-11-15/h4,6-7,10-11,16H,5,8-9,12-14H2,1-3H3,(H,21,26)(H,22,23)(H,24,25)/t16-/m0/s1