2-[4-(3-phenylprop-2-ynyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(3-phenylprop-2-ynyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(3-phenylprop-2-ynyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(3-phenylprop-2-ynyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(3-phenylprop-2-ynyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(3-phenylprop-2-ynyl)piperazino]nicotinonitrile Formula: C19H18N4 MolecularWeight: 302.37302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#CC2=CC=CC=C2)C3=C(C=CC=N3)C#N

Isomeric SMILES

C1CN(CCN1CC#CC2=CC=CC=C2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C19H18N4/c20-16-18-9-4-10-21-19(18)23-14-12-22(13-15-23)11-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10H,11-15H2