1-[4-(furan-2-ylmethyl)piperazin-1-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propan-1-one

Systemtic Name: 1-[4-(furan-2-ylmethyl)piperazin-1-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propan-1-one Openeye Name: 1-[4-(2-furylmethyl)piperazin-1-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propan-1-one CAS Name: 1-[4-(2-furanylmethyl)-1-piperazinyl]-3-(3-methoxy-4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-(furan-2-ylmethyl)piperazin-1-yl]-3-(3-methoxy-4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[4-(2-furfuryl)piperazino]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propan-1-one Formula: C16H21N5O5 MolecularWeight: 363.36844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)N2CCN(CC2)CC3=CC=CO3

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)N2CCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C16H21N5O5/c1-25-16-14(21(23)24)12-20(17-16)5-4-15(22)19-8-6-18(7-9-19)11-13-3-2-10-26-13/h2-3,10,12H,4-9,11H2,1H3