(E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)prop-2-en-1-one CAS Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(4-hydroxyphenyl)prop-2-en-1-one Formula: C25H25ClO2 MolecularWeight: 392.9178

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C4=CC=C(C=C4)Cl)C=CC(=O)C5=CC=C(C=C5)O

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C4=CC=C(C=C4)Cl)/C=C/C(=O)C5=CC=C(C=C5)O

InChI

InChI=1S/C25H25ClO2/c26-21-5-3-20(4-6-21)25-14-17-11-18(15-25)13-24(12-17,16-25)10-9-23(28)19-1-7-22(27)8-2-19/h1-10,17-18,27H,11-16H2/b10-9+