3-(4-methylpiperazin-1-yl)-1-(3-nitrophenyl)propan-1-one

Systemtic Name: 3-(4-methylpiperazin-1-yl)-1-(3-nitrophenyl)propan-1-one Openeye Name: 3-(4-methylpiperazin-1-yl)-1-(3-nitrophenyl)propan-1-one CAS Name: 3-(4-methyl-1-piperazinyl)-1-(3-nitrophenyl)-1-propanone IUPAC Name: 3-(4-methylpiperazin-1-yl)-1-(3-nitrophenyl)propan-1-one Traditional Name: 3-(4-methylpiperazino)-1-(3-nitrophenyl)propan-1-one Formula: C14H19N3O3 MolecularWeight: 277.31896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c1-15-7-9-16(10-8-15)6-5-14(18)12-3-2-4-13(11-12)17(19)20/h2-4,11H,5-10H2,1H3