[4-(2-methylphenyl)piperazin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: (5-nitro-2-furyl)-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-methylphenyl)-1-piperazinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: (5-nitro-2-furyl)-[4-(o-tolyl)piperazino]methanone Formula: C16H17N3O4 MolecularWeight: 315.32388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-12-4-2-3-5-13(12)17-8-10-18(11-9-17)16(20)14-6-7-15(23-14)19(21)22/h2-7H,8-11H2,1H3