1-[3-(1-adamantyl)-4-(3-oxidanylpropoxy)phenyl]prop-2-en-1-one

Systemtic Name: 1-[3-(1-adamantyl)-4-(3-oxidanylpropoxy)phenyl]prop-2-en-1-one Openeye Name: 1-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]prop-2-en-1-one CAS Name: 1-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]-2-propen-1-one IUPAC Name: 1-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]prop-2-en-1-one Traditional Name: 1-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]prop-2-en-1-one Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)C1=CC(=C(C=C1)OCCCO)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CC(=O)C1=CC(=C(C=C1)OCCCO)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28O3/c1-2-20(24)18-4-5-21(25-7-3-6-23)19(11-18)22-12-15-8-16(13-22)10-17(9-15)14-22/h2,4-5,11,15-17,23H,1,3,6-10,12-14H2