1-[(4-bromophenyl)methyl]indole-3-carbonitrile

Systemtic Name: 1-[(4-bromophenyl)methyl]indole-3-carbonitrile Openeye Name: 1-[(4-bromophenyl)methyl]indole-3-carbonitrile CAS Name: 1-[(4-bromophenyl)methyl]-3-indolecarbonitrile IUPAC Name: 1-[(4-bromophenyl)methyl]indole-3-carbonitrile Traditional Name: 1-(4-bromobenzyl)indole-3-carbonitrile Formula: C16H11BrN2 MolecularWeight: 311.17594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C16H11BrN2/c17-14-7-5-12(6-8-14)10-19-11-13(9-18)15-3-1-2-4-16(15)19/h1-8,11H,10H2