6-[4-[(E)-3-(3-chlorophenyl)prop-2-enoyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[(E)-3-(3-chlorophenyl)prop-2-enoyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[(E)-3-(3-chlorophenyl)prop-2-enoyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[(E)-3-(3-chlorophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[(E)-3-(3-chlorophenyl)prop-2-enoyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[(E)-3-(3-chlorophenyl)acryloyl]piperazino]nicotinonitrile Formula: C19H17ClN4O MolecularWeight: 352.81748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN4O/c20-17-3-1-2-15(12-17)5-7-19(25)24-10-8-23(9-11-24)18-6-4-16(13-21)14-22-18/h1-7,12,14H,8-11H2/b7-5+