4-[2-[(pyridin-3-ylmethylamino)methyl]pyrrol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(pyridin-3-ylmethylamino)methyl]pyrrol-1-yl]benzenecarbonitrile Openeye Name: 4-[2-[(3-pyridylmethylamino)methyl]pyrrol-1-yl]benzonitrile CAS Name: 4-[2-[(3-pyridinylmethylamino)methyl]-1-pyrrolyl]benzonitrile IUPAC Name: 4-[2-[(pyridin-3-ylmethylamino)methyl]pyrrol-1-yl]benzonitrile Traditional Name: 4-[2-[(3-pyridylmethylamino)methyl]pyrrol-1-yl]benzonitrile Formula: C18H16N4 MolecularWeight: 288.34644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCC2=CC=CN2C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CN=C1)CNCC2=CC=CN2C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H16N4/c19-11-15-5-7-17(8-6-15)22-10-2-4-18(22)14-21-13-16-3-1-9-20-12-16/h1-10,12,21H,13-14H2