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

Systemtic Name: [4-[(4-methylphenyl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: (5-nitro-2-furyl)-[4-(p-tolylmethyl)piperazin-1-yl]methanone CAS Name: [4-[(4-methylphenyl)methyl]-1-piperazinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-[(4-methylphenyl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: [4-(4-methylbenzyl)piperazino]-(5-nitro-2-furyl)methanone Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4/c1-13-2-4-14(5-3-13)12-18-8-10-19(11-9-18)17(21)15-6-7-16(24-15)20(22)23/h2-7H,8-12H2,1H3