methyl 2-[(E)-4-(phenylmethoxycarbonylamino)but-1-enyl]benzoate

Systemtic Name: methyl 2-[(E)-4-(phenylmethoxycarbonylamino)but-1-enyl]benzoate Openeye Name: methyl 2-[(E)-4-(benzyloxycarbonylamino)but-1-enyl]benzoate CAS Name: 2-[(E)-4-(phenylmethoxycarbonylamino)but-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-4-(phenylmethoxycarbonylamino)but-1-enyl]benzoate Traditional Name: 2-[(E)-4-(benzyloxycarbonylamino)but-1-enyl]benzoic acid methyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C=CCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1/C=C/CCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21NO4/c1-24-19(22)18-13-6-5-11-17(18)12-7-8-14-21-20(23)25-15-16-9-3-2-4-10-16/h2-7,9-13H,8,14-15H2,1H3,(H,21,23)/b12-7+