2-(2-methoxy-6-nitro-phenyl)-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(2-methoxy-6-nitro-phenyl)-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(2-methoxy-6-nitro-phenyl)-3-(4-methylpiperazin-1-yl)-3-oxo-propanenitrile CAS Name: 2-(2-methoxy-6-nitrophenyl)-3-(4-methyl-1-piperazinyl)-3-oxopropanenitrile IUPAC Name: 2-(2-methoxy-6-nitrophenyl)-3-(4-methylpiperazin-1-yl)-3-oxopropanenitrile Traditional Name: 3-keto-2-(2-methoxy-6-nitro-phenyl)-3-(4-methylpiperazino)propionitrile Formula: C15H18N4O4 MolecularWeight: 318.32782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(C#N)C2=C(C=CC=C2OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C(C#N)C2=C(C=CC=C2OC)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4/c1-17-6-8-18(9-7-17)15(20)11(10-16)14-12(19(21)22)4-3-5-13(14)23-2/h3-5,11H,6-9H2,1-2H3