1-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one

Systemtic Name: 1-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 1-[4-(2-furylmethyl)piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 1-[4-(2-furanylmethyl)-1-piperazinyl]-2-methyl-3-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[4-(2-furfuryl)piperazino]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=CO3

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C16H21N5O4/c1-13(10-20-11-14(9-17-20)21(23)24)16(22)19-6-4-18(5-7-19)12-15-3-2-8-25-15/h2-3,8-9,11,13H,4-7,10,12H2,1H3