2-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-7-methoxy-quinoline-3-carbonitrile

Systemtic Name: 2-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-7-methoxy-quinoline-3-carbonitrile Openeye Name: 2-[4-(3-chlorobenzoyl)piperazin-1-yl]-7-methoxy-quinoline-3-carbonitrile CAS Name: 2-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]-7-methoxy-3-quinolinecarbonitrile IUPAC Name: 2-[4-(3-chlorobenzoyl)piperazin-1-yl]-7-methoxyquinoline-3-carbonitrile Traditional Name: 2-[4-(3-chlorobenzoyl)piperazino]-7-methoxy-quinoline-3-carbonitrile Formula: C22H19ClN4O2 MolecularWeight: 406.86486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C22H19ClN4O2/c1-29-19-6-5-15-11-17(14-24)21(25-20(15)13-19)26-7-9-27(10-8-26)22(28)16-3-2-4-18(23)12-16/h2-6,11-13H,7-10H2,1H3