ethyl (3R,4S)-1-(4-ethoxycarbonylphenyl)-2-oxidanylidene-4-phenyl-azetidine-3-carboxylate

Systemtic Name: ethyl (3R,4S)-1-(4-ethoxycarbonylphenyl)-2-oxidanylidene-4-phenyl-azetidine-3-carboxylate Openeye Name: ethyl (3R,4S)-1-(4-ethoxycarbonylphenyl)-2-oxo-4-phenyl-azetidine-3-carboxylate CAS Name: (3R,4S)-1-(4-ethoxycarbonylphenyl)-2-oxo-4-phenyl-3-azetidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4S)-1-(4-ethoxycarbonylphenyl)-2-oxo-4-phenylazetidine-3-carboxylate Traditional Name: (3R,4S)-1-(4-carbethoxyphenyl)-2-keto-4-phenyl-azetidine-3-carboxylic acid ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N(C1=O)C2=CC=C(C=C2)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](N(C1=O)C2=CC=C(C=C2)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO5/c1-3-26-20(24)15-10-12-16(13-11-15)22-18(14-8-6-5-7-9-14)17(19(22)23)21(25)27-4-2/h5-13,17-18H,3-4H2,1-2H3/t17-,18-/m1/s1