tert-butyl (3S,4R)-4-oxidanyl-3-(phenylmethoxyamino)azepane-1-carboxylate

Systemtic Name: tert-butyl (3S,4R)-4-oxidanyl-3-(phenylmethoxyamino)azepane-1-carboxylate Openeye Name: tert-butyl (3S,4R)-3-(benzyloxyamino)-4-hydroxy-azepane-1-carboxylate CAS Name: (3S,4R)-4-hydroxy-3-(phenylmethoxyamino)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4R)-4-hydroxy-3-(phenylmethoxyamino)azepane-1-carboxylate Traditional Name: (3S,4R)-3-(benzoxyamino)-4-hydroxy-azepane-1-carboxylic acid tert-butyl ester Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C(C1)NOCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]([C@H](C1)NOCC2=CC=CC=C2)O

InChI

InChI=1S/C18H28N2O4/c1-18(2,3)24-17(22)20-11-7-10-16(21)15(12-20)19-23-13-14-8-5-4-6-9-14/h4-6,8-9,15-16,19,21H,7,10-13H2,1-3H3/t15-,16+/m0/s1