2-chloranyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]nicotinamide Formula: C25H23ClN4O2 MolecularWeight: 446.92872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H23ClN4O2/c26-24-22(7-4-14-27-24)25(32)28-20-9-11-21(12-10-20)29-15-17-30(18-16-29)23(31)13-8-19-5-2-1-3-6-19/h1-14H,15-18H2,(H,28,32)/b13-8+