(E)-N-[3-(3-methyl-1-oxidanyl-4-oxidanylidene-2-propan-2-yloxy-cyclobut-2-en-1-yl)prop-2-ynyl]-3-phenyl-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-N-[3-(3-methyl-1-oxidanyl-4-oxidanylidene-2-propan-2-yloxy-cyclobut-2-en-1-yl)prop-2-ynyl]-3-phenyl-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-N-[3-(1-hydroxy-2-isopropoxy-3-methyl-4-oxo-cyclobut-2-en-1-yl)prop-2-ynyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[3-(1-hydroxy-3-methyl-4-oxo-2-propan-2-yloxy-1-cyclobut-2-enyl)prop-2-ynyl]-3-phenyl-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-N-[3-(1-hydroxy-3-methyl-4-oxo-2-propan-2-yloxycyclobut-2-en-1-yl)prop-2-ynyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-benzyl-N-[3-(1-hydroxy-2-isopropoxy-4-keto-3-methyl-cyclobut-2-en-1-yl)prop-2-ynyl]-3-phenyl-acrylamide Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C1=O)(C#CCN(CC2=CC=CC=C2)C(=O)C=CC3=CC=CC=C3)O)OC(C)C

Isomeric SMILES

CC1=C(C(C1=O)(C#CCN(CC2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3)O)OC(C)C

InChI

InChI=1S/C27H27NO4/c1-20(2)32-26-21(3)25(30)27(26,31)17-10-18-28(19-23-13-8-5-9-14-23)24(29)16-15-22-11-6-4-7-12-22/h4-9,11-16,20,31H,18-19H2,1-3H3/b16-15+