(3R,4S)-4-(2,5-dimethyl-3-oxidanylidene-hex-4-en-2-yl)-3-phenylmethoxy-1-prop-2-ynyl-azetidin-2-one

Systemtic Name: (3R,4S)-4-(2,5-dimethyl-3-oxidanylidene-hex-4-en-2-yl)-3-phenylmethoxy-1-prop-2-ynyl-azetidin-2-one Openeye Name: (3R,4S)-3-benzyloxy-1-prop-2-ynyl-4-(1,1,4-trimethyl-2-oxo-pent-3-enyl)azetidin-2-one CAS Name: (3R,4S)-4-(2,5-dimethyl-3-oxohex-4-en-2-yl)-3-phenylmethoxy-1-prop-2-ynyl-2-azetidinone IUPAC Name: (3R,4S)-4-(2,5-dimethyl-3-oxohex-4-en-2-yl)-3-phenylmethoxy-1-prop-2-ynylazetidin-2-one Traditional Name: (3R,4S)-3-benzoxy-4-(2-keto-1,1,4-trimethyl-pent-3-enyl)-1-propargyl-azetidin-2-one Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C(C)(C)C1C(C(=O)N1CC#C)OCC2=CC=CC=C2)C

Isomeric SMILES

CC(=CC(=O)C(C)(C)[C@H]1[C@H](C(=O)N1CC#C)OCC2=CC=CC=C2)C

InChI

InChI=1S/C21H25NO3/c1-6-12-22-19(21(4,5)17(23)13-15(2)3)18(20(22)24)25-14-16-10-8-7-9-11-16/h1,7-11,13,18-19H,12,14H2,2-5H3/t18-,19-/m1/s1