(phenylmethyl) 3-[2-fluoranyl-4-(phenylmethoxycarbonylamino)phenyl]azetidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[2-fluoranyl-4-(phenylmethoxycarbonylamino)phenyl]azetidine-1-carboxylate Openeye Name: benzyl 3-[4-(benzyloxycarbonylamino)-2-fluoro-phenyl]azetidine-1-carboxylate CAS Name: 3-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]-1-azetidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]azetidine-1-carboxylate Traditional Name: 3-[4-(benzyloxycarbonylamino)-2-fluoro-phenyl]azetidine-1-carboxylic acid benzyl ester Formula: C25H23FN2O4 MolecularWeight: 434.459523

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C(=O)OCC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)OCC4=CC=CC=C4)F

Isomeric SMILES

C1C(CN1C(=O)OCC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)OCC4=CC=CC=C4)F

InChI

InChI=1S/C25H23FN2O4/c26-23-13-21(27-24(29)31-16-18-7-3-1-4-8-18)11-12-22(23)20-14-28(15-20)25(30)32-17-19-9-5-2-6-10-19/h1-13,20H,14-17H2,(H,27,29)