1-[4-[3-(furan-2-ylmethylamino)-4-nitro-phenyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[3-(furan-2-ylmethylamino)-4-nitro-phenyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[3-(2-furylmethylamino)-4-nitro-phenyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[3-(2-furanylmethylamino)-4-nitrophenyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[3-(2-furfurylamino)-4-nitro-phenyl]piperazino]propan-1-one Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3

InChI

InChI=1S/C18H22N4O4/c1-2-18(23)21-9-7-20(8-10-21)14-5-6-17(22(24)25)16(12-14)19-13-15-4-3-11-26-15/h3-6,11-12,19H,2,7-10,13H2,1H3