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

Systemtic Name: 1-[4-[3-(furan-2-ylmethylamino)-4-nitro-phenyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[3-(2-furylmethylamino)-4-nitro-phenyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[3-(2-furanylmethylamino)-4-nitrophenyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[3-(2-furfurylamino)-4-nitro-phenyl]piperazino]-2-methyl-propan-1-one Formula: C19H24N4O4 MolecularWeight: 372.41826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O4/c1-14(2)19(24)22-9-7-21(8-10-22)15-5-6-18(23(25)26)17(12-15)20-13-16-4-3-11-27-16/h3-6,11-12,14,20H,7-10,13H2,1-2H3