2-[[3-bromanyl-5-(phenylmethyl)phenyl]methyl]pyrazine

Systemtic Name: 2-[[3-bromanyl-5-(phenylmethyl)phenyl]methyl]pyrazine Openeye Name: 2-[(3-benzyl-5-bromo-phenyl)methyl]pyrazine CAS Name: 2-[[3-bromo-5-(phenylmethyl)phenyl]methyl]pyrazine IUPAC Name: 2-[(3-benzyl-5-bromophenyl)methyl]pyrazine Traditional Name: 2-(3-benzyl-5-bromo-benzyl)pyrazine Formula: C18H15BrN2 MolecularWeight: 339.2291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CC(=C2)Br)CC3=NC=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CC(=C2)Br)CC3=NC=CN=C3

InChI

InChI=1S/C18H15BrN2/c19-17-10-15(8-14-4-2-1-3-5-14)9-16(11-17)12-18-13-20-6-7-21-18/h1-7,9-11,13H,8,12H2