(E)-3-(1-adamantyl)-1-(3-phenylmethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-adamantyl)-1-(3-phenylmethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-(1-adamantyl)-1-(3-benzyloxyphenyl)prop-2-en-1-one CAS Name: (E)-3-(1-adamantyl)-1-(3-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-(1-adamantyl)-1-(3-phenylmethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(1-adamantyl)-1-(3-benzoxyphenyl)prop-2-en-1-one Formula: C26H28O2 MolecularWeight: 372.49932

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C=CC(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)/C=C/C(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H28O2/c27-25(9-10-26-15-20-11-21(16-26)13-22(12-20)17-26)23-7-4-8-24(14-23)28-18-19-5-2-1-3-6-19/h1-10,14,20-22H,11-13,15-18H2/b10-9+