(4-fluorophenyl) (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-azepane-1-carboxylate

Systemtic Name: (4-fluorophenyl) (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-azepane-1-carboxylate Openeye Name: (4-fluorophenyl) (3R)-3-(tert-butoxycarbonylamino)-2-oxo-azepane-1-carboxylate CAS Name: (3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-1-azepanecarboxylic acid (4-fluorophenyl) ester IUPAC Name: (4-fluorophenyl) (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoazepane-1-carboxylate Traditional Name: (3R)-3-(tert-butoxycarbonylamino)-2-keto-azepane-1-carboxylic acid (4-fluorophenyl) ester Formula: C18H23FN2O5 MolecularWeight: 366.384023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCCCN(C1=O)C(=O)OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CCCCN(C1=O)C(=O)OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN2O5/c1-18(2,3)26-16(23)20-14-6-4-5-11-21(15(14)22)17(24)25-13-9-7-12(19)8-10-13/h7-10,14H,4-6,11H2,1-3H3,(H,20,23)/t14-/m1/s1