4-[2-[[butyl(ethyl)amino]methyl]pyrrol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[[butyl(ethyl)amino]methyl]pyrrol-1-yl]benzenecarbonitrile Openeye Name: 4-[2-[[butyl(ethyl)amino]methyl]pyrrol-1-yl]benzonitrile CAS Name: 4-[2-[[butyl(ethyl)amino]methyl]-1-pyrrolyl]benzonitrile IUPAC Name: 4-[2-[[butyl(ethyl)amino]methyl]pyrrol-1-yl]benzonitrile Traditional Name: 4-[2-[[butyl(ethyl)amino]methyl]pyrrol-1-yl]benzonitrile Formula: C18H23N3 MolecularWeight: 281.39532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)CC1=CC=CN1C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCN(CC)CC1=CC=CN1C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H23N3/c1-3-5-12-20(4-2)15-18-7-6-13-21(18)17-10-8-16(14-19)9-11-17/h6-11,13H,3-5,12,15H2,1-2H3