5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[4-(4-phenylphenyl)butanoylamino]oxy-hexanoic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[4-(4-phenylphenyl)butanoylamino]oxy-hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-6-oxo-6-[4-(4-phenylphenyl)butanoylamino]oxy-hexanoic acid CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-6-[[1-oxo-4-(4-phenylphenyl)butyl]amino]oxyhexanoic acid IUPAC Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-[4-(4-phenylphenyl)butanoylamino]oxyhexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-[4-(4-phenylphenyl)butanoylamino]oxy-hexanoic acid Formula: C27H34N2O7 MolecularWeight: 498.56806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)ONC(=O)CCCC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)ONC(=O)CCCC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C27H34N2O7/c1-27(2,3)35-26(34)28-22(12-8-14-24(31)32)25(33)36-29-23(30)13-7-9-19-15-17-21(18-16-19)20-10-5-4-6-11-20/h4-6,10-11,15-18,22H,7-9,12-14H2,1-3H3,(H,28,34)(H,29,30)(H,31,32)