7-methyl-2-oxidanyl-2-(phenylmethoxycarbonylamino)octanoic acid

Systemtic Name: 7-methyl-2-oxidanyl-2-(phenylmethoxycarbonylamino)octanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-hydroxy-7-methyl-octanoic acid CAS Name: 2-hydroxy-7-methyl-2-(phenylmethoxycarbonylamino)octanoic acid IUPAC Name: 2-hydroxy-7-methyl-2-(phenylmethoxycarbonylamino)octanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-hydroxy-7-methyl-caprylic acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO5/c1-13(2)8-6-7-11-17(22,15(19)20)18-16(21)23-12-14-9-4-3-5-10-14/h3-5,9-10,13,22H,6-8,11-12H2,1-2H3,(H,18,21)(H,19,20)