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

Systemtic Name: (E)-3-(1-adamantyl)-1-(4-methoxy-3-methyl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(1-adamantyl)-1-(4-methoxy-3-methyl-phenyl)prop-2-en-1-one CAS Name: (E)-3-(1-adamantyl)-1-(4-methoxy-3-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(1-adamantyl)-1-(4-methoxy-3-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(1-adamantyl)-1-(4-methoxy-3-methyl-phenyl)prop-2-en-1-one Formula: C21H26O2 MolecularWeight: 310.42994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C=CC23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)/C=C/C23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C21H26O2/c1-14-7-18(3-4-20(14)23-2)19(22)5-6-21-11-15-8-16(12-21)10-17(9-15)13-21/h3-7,15-17H,8-13H2,1-2H3/b6-5+