methyl 2-(fluoranylmethyl)-3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 2-(fluoranylmethyl)-3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-(fluoromethyl)-3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 2-(fluoromethyl)-3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propionic acid methyl ester Formula: C16H18FN3O4 MolecularWeight: 335.330223

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=CN1)(CF)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1=CN=CN1)(CF)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H18FN3O4/c1-23-14(21)16(10-17,7-13-8-18-11-19-13)20-15(22)24-9-12-5-3-2-4-6-12/h2-6,8,11H,7,9-10H2,1H3,(H,18,19)(H,20,22)