(E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28O4/c1-24-18-9-14(10-19(25-2)21(18)26-3)4-5-20(23)22-11-15-6-16(12-22)8-17(7-15)13-22/h4-5,9-10,15-17H,6-8,11-13H2,1-3H3/b5-4+