4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-oxidanyl-3-propan-2-yloxy-cyclobut-2-en-1-one

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-oxidanyl-3-propan-2-yloxy-cyclobut-2-en-1-one Openeye Name: 4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-hydroxy-3-isopropoxy-cyclobut-2-en-1-one CAS Name: 4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-hydroxy-3-propan-2-yloxy-1-cyclobut-2-enone IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-hydroxy-3-propan-2-yloxycyclobut-2-en-1-one Traditional Name: 4-(3,4-dimethoxyphenyl)-2-hex-1-ynyl-4-hydroxy-3-isopropoxy-cyclobut-2-en-1-one Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C(C1=O)(C2=CC(=C(C=C2)OC)OC)O)OC(C)C

Isomeric SMILES

CCCCC#CC1=C(C(C1=O)(C2=CC(=C(C=C2)OC)OC)O)OC(C)C

InChI

InChI=1S/C21H26O5/c1-6-7-8-9-10-16-19(22)21(23,20(16)26-14(2)3)15-11-12-17(24-4)18(13-15)25-5/h11-14,23H,6-8H2,1-5H3