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

Systemtic Name: (E)-1-(1-adamantyl)-3-pyridin-3-yl-prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(3-pyridyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-(3-pyridinyl)-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-pyridin-3-ylprop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(3-pyridyl)prop-2-en-1-one Formula: C18H21NO MolecularWeight: 267.36544

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C=CC4=CN=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)/C=C/C4=CN=CC=C4

InChI

InChI=1S/C18H21NO/c20-17(4-3-13-2-1-5-19-12-13)18-9-14-6-15(10-18)8-16(7-14)11-18/h1-5,12,14-16H,6-11H2/b4-3+