1-[4-(3-nitrophenyl)piperazin-1-yl]butane-1,3-dione

Systemtic Name: 1-[4-(3-nitrophenyl)piperazin-1-yl]butane-1,3-dione Openeye Name: 1-[4-(3-nitrophenyl)piperazin-1-yl]butane-1,3-dione CAS Name: 1-[4-(3-nitrophenyl)-1-piperazinyl]butane-1,3-dione IUPAC Name: 1-[4-(3-nitrophenyl)piperazin-1-yl]butane-1,3-dione Traditional Name: 1-[4-(3-nitrophenyl)piperazino]butane-1,3-dione Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)N1CCN(CC1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CC(=O)N1CCN(CC1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4/c1-11(18)9-14(19)16-7-5-15(6-8-16)12-3-2-4-13(10-12)17(20)21/h2-4,10H,5-9H2,1H3