4-[C-butyl-N-(2,4,4-trimethylpentan-2-yl)carbonimidoyl]-4-oxidanyl-2-phenyl-3-propan-2-yloxy-cyclobut-2-en-1-one

Systemtic Name: 4-[C-butyl-N-(2,4,4-trimethylpentan-2-yl)carbonimidoyl]-4-oxidanyl-2-phenyl-3-propan-2-yloxy-cyclobut-2-en-1-one Openeye Name: 4-[C-butyl-N-(1,1,3,3-tetramethylbutyl)carbonimidoyl]-4-hydroxy-3-isopropoxy-2-phenyl-cyclobut-2-en-1-one CAS Name: 4-hydroxy-2-phenyl-3-propan-2-yloxy-4-[1-(2,4,4-trimethylpentan-2-ylimino)pentyl]-1-cyclobut-2-enone IUPAC Name: 4-[C-butyl-N-(2,4,4-trimethylpentan-2-yl)carbonimidoyl]-4-hydroxy-2-phenyl-3-propan-2-yloxycyclobut-2-en-1-one Traditional Name: 4-[C-butyl-N-(1,1,3,3-tetramethylbutyl)carbonimidoyl]-4-hydroxy-3-isopropoxy-2-phenyl-cyclobut-2-en-1-one Formula: C26H39NO3 MolecularWeight: 413.59276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NC(C)(C)CC(C)(C)C)C1(C(=C(C1=O)C2=CC=CC=C2)OC(C)C)O

Isomeric SMILES

CCCCC(=NC(C)(C)CC(C)(C)C)C1(C(=C(C1=O)C2=CC=CC=C2)OC(C)C)O

InChI

InChI=1S/C26H39NO3/c1-9-10-16-20(27-25(7,8)17-24(4,5)6)26(29)22(28)21(23(26)30-18(2)3)19-14-12-11-13-15-19/h11-15,18,29H,9-10,16-17H2,1-8H3