2-(3-nitrophenyl)-1-(4-pyridin-3-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 2-(3-nitrophenyl)-1-(4-pyridin-3-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 2-(3-nitrophenyl)-1-[4-(pyridine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: 2-(3-nitrophenyl)-1-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: 2-(3-nitrophenyl)-1-[4-(pyridine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: 1-(4-nicotinoylpiperazino)-2-(3-nitrophenyl)prop-2-en-1-one Formula: C19H18N4O4 MolecularWeight: 366.37062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=CC=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

C=C(C1=CC(=CC=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H18N4O4/c1-14(15-4-2-6-17(12-15)23(26)27)18(24)21-8-10-22(11-9-21)19(25)16-5-3-7-20-13-16/h2-7,12-13H,1,8-11H2