4-[[(4-bromophenyl)methyl-[4-(dipropylamino)butyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(4-bromophenyl)methyl-[4-(dipropylamino)butyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(4-bromophenyl)methyl-[4-(dipropylamino)butyl]amino]methyl]benzonitrile CAS Name: 4-[[(4-bromophenyl)methyl-[4-(dipropylamino)butyl]amino]methyl]benzonitrile IUPAC Name: 4-[[(4-bromophenyl)methyl-[4-(dipropylamino)butyl]amino]methyl]benzonitrile Traditional Name: 4-[[(4-bromobenzyl)-[4-(dipropylamino)butyl]amino]methyl]benzonitrile Formula: C25H34BrN3 MolecularWeight: 456.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCCN(CC1=CC=C(C=C1)C#N)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCN(CCC)CCCCN(CC1=CC=C(C=C1)C#N)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C25H34BrN3/c1-3-15-28(16-4-2)17-5-6-18-29(21-24-11-13-25(26)14-12-24)20-23-9-7-22(19-27)8-10-23/h7-14H,3-6,15-18,20-21H2,1-2H3