tert-butyl (2R,3S)-3-ethyl-2-(4-nitrophenyl)-4-oxidanylidene-3-phenyl-azetidine-1-carboxylate

Systemtic Name: tert-butyl (2R,3S)-3-ethyl-2-(4-nitrophenyl)-4-oxidanylidene-3-phenyl-azetidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-ethyl-2-(4-nitrophenyl)-4-oxo-3-phenyl-azetidine-1-carboxylate CAS Name: (2R,3S)-3-ethyl-2-(4-nitrophenyl)-4-oxo-3-phenyl-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-ethyl-2-(4-nitrophenyl)-4-oxo-3-phenylazetidine-1-carboxylate Traditional Name: (3S,4R)-3-ethyl-2-keto-4-(4-nitrophenyl)-3-phenyl-azetidine-1-carboxylic acid tert-butyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)OC(C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC[C@@]1([C@H](N(C1=O)C(=O)OC(C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-5-22(16-9-7-6-8-10-16)18(15-11-13-17(14-12-15)24(27)28)23(19(22)25)20(26)29-21(2,3)4/h6-14,18H,5H2,1-4H3/t18-,22+/m1/s1