(4S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylate

Systemtic Name: (4S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylate Openeye Name: (4S)-1-tert-butoxycarbonyl-4-methyl-azepane-4-carboxylate CAS Name: (4S)-4-methyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-azepanecarboxylate IUPAC Name: (4S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylate Traditional Name: (4S)-1-tert-butoxycarbonyl-4-methyl-azepane-4-carboxylate Formula: C13H22NO4- MolecularWeight: 256.31808

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(CC1)C(=O)OC(C)(C)C)C(=O)[O-]

Isomeric SMILES

C[C@@]1(CCCN(CC1)C(=O)OC(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C13H23NO4/c1-12(2,3)18-11(17)14-8-5-6-13(4,7-9-14)10(15)16/h5-9H2,1-4H3,(H,15,16)/p-1/t13-/m0/s1