(phenylmethyl) 2-(3-benzamido-2-chloranyl-4-oxidanylidene-azetidin-1-yl)-3-(chloromethyl)but-3-enoate

Systemtic Name: (phenylmethyl) 2-(3-benzamido-2-chloranyl-4-oxidanylidene-azetidin-1-yl)-3-(chloromethyl)but-3-enoate Openeye Name: benzyl 2-(3-benzamido-2-chloro-4-oxo-azetidin-1-yl)-3-(chloromethyl)but-3-enoate CAS Name: 2-(3-benzamido-2-chloro-4-oxo-1-azetidinyl)-3-(chloromethyl)-3-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-benzamido-2-chloro-4-oxoazetidin-1-yl)-3-(chloromethyl)but-3-enoate Traditional Name: 2-(3-benzamido-2-chloro-4-keto-azetidin-1-yl)-3-(chloromethyl)but-3-enoic acid benzyl ester Formula: C22H20Cl2N2O4 MolecularWeight: 447.3112

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CCl)C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)NC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C=C(CCl)C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)NC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H20Cl2N2O4/c1-14(12-23)18(22(29)30-13-15-8-4-2-5-9-15)26-19(24)17(21(26)28)25-20(27)16-10-6-3-7-11-16/h2-11,17-19H,1,12-13H2,(H,25,27)