(E)-1-(1-adamantyl)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1-adamantyl)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-(3-hydroxy-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-en-1-one Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C20H24O3/c1-23-18-4-2-13(9-17(18)21)3-5-19(22)20-10-14-6-15(11-20)8-16(7-14)12-20/h2-5,9,14-16,21H,6-8,10-12H2,1H3/b5-3+