[3-bromanyl-5-(phenylmethyl)phenyl]-pyrazin-2-yl-methanone

Systemtic Name: [3-bromanyl-5-(phenylmethyl)phenyl]-pyrazin-2-yl-methanone Openeye Name: (3-benzyl-5-bromo-phenyl)-pyrazin-2-yl-methanone CAS Name: [3-bromo-5-(phenylmethyl)phenyl]-(2-pyrazinyl)methanone IUPAC Name: (3-benzyl-5-bromophenyl)-pyrazin-2-ylmethanone Traditional Name: (3-benzyl-5-bromo-phenyl)-pyrazin-2-yl-methanone Formula: C18H13BrN2O MolecularWeight: 353.21262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O/c19-16-10-14(8-13-4-2-1-3-5-13)9-15(11-16)18(22)17-12-20-6-7-21-17/h1-7,9-12H,8H2