(E)-N-[4-(2,3-diethoxy-1-oxidanyl-4-oxidanylidene-cyclobut-2-en-1-yl)but-3-yn-2-yl]-3-phenyl-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(2,3-diethoxy-1-oxidanyl-4-oxidanylidene-cyclobut-2-en-1-yl)but-3-yn-2-yl]-3-phenyl-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-N-[3-(2,3-diethoxy-1-hydroxy-4-oxo-cyclobut-2-en-1-yl)-1-methyl-prop-2-ynyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-(2,3-diethoxy-1-hydroxy-4-oxo-1-cyclobut-2-enyl)but-3-yn-2-yl]-3-phenyl-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-N-[4-(2,3-diethoxy-1-hydroxy-4-oxocyclobut-2-en-1-yl)but-3-yn-2-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-benzyl-N-[3-(2,3-diethoxy-1-hydroxy-4-keto-cyclobut-2-en-1-yl)-1-methyl-prop-2-ynyl]-3-phenyl-acrylamide Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(C1=O)(C#CC(C)N(CC2=CC=CC=C2)C(=O)C=CC3=CC=CC=C3)O)OCC

Isomeric SMILES

CCOC1=C(C(C1=O)(C#CC(C)N(CC2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3)O)OCC

InChI

InChI=1S/C28H29NO5/c1-4-33-25-26(31)28(32,27(25)34-5-2)19-18-21(3)29(20-23-14-10-7-11-15-23)24(30)17-16-22-12-8-6-9-13-22/h6-17,21,32H,4-5,20H2,1-3H3/b17-16+