1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol

Systemtic Name: 1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol Openeye Name: 1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol CAS Name: 1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol IUPAC Name: 1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol Traditional Name: 1-[(E)-but-1-enyl]-3-(2-phenylethynyl)cyclohexa-2,5-diene-1,4-diol Formula: C18H18O2 MolecularWeight: 266.33432

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1(C=CC(C(=C1)C#CC2=CC=CC=C2)O)O

Isomeric SMILES

CC/C=C/C1(C=CC(C(=C1)C#CC2=CC=CC=C2)O)O

InChI

InChI=1S/C18H18O2/c1-2-3-12-18(20)13-11-17(19)16(14-18)10-9-15-7-5-4-6-8-15/h3-8,11-14,17,19-20H,2H2,1H3/b12-3+