2-tert-butyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 2-tert-butyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 4-(benzyloxycarbonylamino)-2-tert-butyl-5-oxo-pentanoic acid CAS Name: 2-tert-butyl-5-oxo-4-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 2-tert-butyl-5-oxo-4-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 4-(benzyloxycarbonylamino)-2-tert-butyl-5-keto-valeric acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(C=O)NC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)C(CC(C=O)NC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C17H23NO5/c1-17(2,3)14(15(20)21)9-13(10-19)18-16(22)23-11-12-7-5-4-6-8-12/h4-8,10,13-14H,9,11H2,1-3H3,(H,18,22)(H,20,21)