1-[4-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[(6-chloro-3-pyridinyl)-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(6-chloronicotinoyl)piperazino]phenyl]ethanone Formula: C18H18ClN3O2 MolecularWeight: 343.80742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2/c1-13(23)14-2-5-16(6-3-14)21-8-10-22(11-9-21)18(24)15-4-7-17(19)20-12-15/h2-7,12H,8-11H2,1H3