[4-(furan-2-ylmethyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone

Systemtic Name: [4-(furan-2-ylmethyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone Openeye Name: [4-(2-furylmethyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone CAS Name: [4-(2-furanylmethyl)-1-piperazinyl]-(3-methyl-4-nitrophenyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)piperazin-1-yl]-(3-methyl-4-nitrophenyl)methanone Traditional Name: [4-(2-furfuryl)piperazino]-(3-methyl-4-nitro-phenyl)methanone Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CO3)[N+](=O)[O-]

InChI

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