(E)-1-(1-adamantyl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(1-adamantyl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(5-methyl-2-thienyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-(5-methyl-2-thiophenyl)-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(5-methyl-2-thienyl)prop-2-en-1-one Formula: C18H22OS MolecularWeight: 286.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22OS/c1-12-2-3-16(20-12)4-5-17(19)18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3/b5-4+