1-(bromomethyl)-3-(4-methylphenyl)adamantane

Systemtic Name: 1-(bromomethyl)-3-(4-methylphenyl)adamantane Openeye Name: 1-(bromomethyl)-3-(p-tolyl)adamantane CAS Name: 1-(bromomethyl)-3-(4-methylphenyl)adamantane IUPAC Name: 1-(bromomethyl)-3-(4-methylphenyl)adamantane Traditional Name: 1-(bromomethyl)-3-(p-tolyl)adamantane Formula: C18H23Br MolecularWeight: 319.27922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CBr

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CBr

InChI

InChI=1S/C18H23Br/c1-13-2-4-16(5-3-13)18-9-14-6-15(10-18)8-17(7-14,11-18)12-19/h2-5,14-15H,6-12H2,1H3