(E)-1-(1-adamantyl)-3-(4-bromophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1-adamantyl)-3-(4-bromophenyl)prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(4-bromophenyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-(4-bromophenyl)-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-(4-bromophenyl)prop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(4-bromophenyl)prop-2-en-1-one Formula: C19H21BrO MolecularWeight: 345.27344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrO/c20-17-4-1-13(2-5-17)3-6-18(21)19-10-14-7-15(11-19)9-16(8-14)12-19/h1-6,14-16H,7-12H2/b6-3+