[(2R,3R)-2-buta-2,3-dienoyl-4-oxidanylidene-1-(phenylmethyl)azetidin-3-yl] 4-methoxybenzoate

Systemtic Name: [(2R,3R)-2-buta-2,3-dienoyl-4-oxidanylidene-1-(phenylmethyl)azetidin-3-yl] 4-methoxybenzoate Openeye Name: [(2R,3R)-1-benzyl-2-buta-2,3-dienoyl-4-oxo-azetidin-3-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(3R,4R)-2-oxo-4-(1-oxobuta-2,3-dienyl)-1-(phenylmethyl)-3-azetidinyl] ester IUPAC Name: [(2R,3R)-1-benzyl-2-buta-2,3-dienoyl-4-oxoazetidin-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(2R,3R)-1-benzyl-2-buta-2,3-dienoyl-4-keto-azetidin-3-yl] ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2C(N(C2=O)CC3=CC=CC=C3)C(=O)C=C=C

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)O[C@@H]2[C@@H](N(C2=O)CC3=CC=CC=C3)C(=O)C=C=C

InChI

InChI=1S/C22H19NO5/c1-3-7-18(24)19-20(21(25)23(19)14-15-8-5-4-6-9-15)28-22(26)16-10-12-17(27-2)13-11-16/h4-13,19-20H,1,14H2,2H3/t19-,20+/m0/s1