methyl 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-oxidanylidene-azetidin-2-yl]benzoate

Systemtic Name: methyl 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-oxidanylidene-azetidin-2-yl]benzoate Openeye Name: methyl 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-oxo-azetidin-2-yl]benzoate CAS Name: 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-oxo-2-azetidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-oxoazetidin-2-yl]benzoate Traditional Name: 4-[(2S,3R)-1-(4-chlorophenyl)-3-ethyl-4-keto-azetidin-2-yl]benzoic acid methyl ester Formula: C19H18ClNO3 MolecularWeight: 343.80412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N(C1=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClNO3/c1-3-16-17(12-4-6-13(7-5-12)19(23)24-2)21(18(16)22)15-10-8-14(20)9-11-15/h4-11,16-17H,3H2,1-2H3/t16-,17-/m1/s1