2-[4-(4-bromophenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(4-bromophenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(4-bromobenzoyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(4-bromobenzoyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(4-bromobenzoyl)piperazino]isonicotinonitrile Formula: C17H15BrN4O MolecularWeight: 371.2312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4O/c18-15-3-1-14(2-4-15)17(23)22-9-7-21(8-10-22)16-11-13(12-19)5-6-20-16/h1-6,11H,7-10H2