3-(4-bromanyl-1-phenyl-butyl)-1-methyl-indole-2-carbonitrile

Systemtic Name: 3-(4-bromanyl-1-phenyl-butyl)-1-methyl-indole-2-carbonitrile Openeye Name: 3-(4-bromo-1-phenyl-butyl)-1-methyl-indole-2-carbonitrile CAS Name: 3-(4-bromo-1-phenylbutyl)-1-methyl-2-indolecarbonitrile IUPAC Name: 3-(4-bromo-1-phenylbutyl)-1-methylindole-2-carbonitrile Traditional Name: 3-(4-bromo-1-phenyl-butyl)-1-methyl-indole-2-carbonitrile Formula: C20H19BrN2 MolecularWeight: 367.28226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C#N)C(CCCBr)C3=CC=CC=C3

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C#N)C(CCCBr)C3=CC=CC=C3

InChI

InChI=1S/C20H19BrN2/c1-23-18-12-6-5-10-17(18)20(19(23)14-22)16(11-7-13-21)15-8-3-2-4-9-15/h2-6,8-10,12,16H,7,11,13H2,1H3