1-[3-nitro-4-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanone

Systemtic Name: 1-[3-nitro-4-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanone Openeye Name: 1-[4-(4-isopropylpiperazin-1-yl)-3-nitro-phenyl]ethanone CAS Name: 1-[3-nitro-4-(4-propan-2-yl-1-piperazinyl)phenyl]ethanone IUPAC Name: 1-[3-nitro-4-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanone Traditional Name: 1-[4-(4-isopropylpiperazino)-3-nitro-phenyl]ethanone Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O3/c1-11(2)16-6-8-17(9-7-16)14-5-4-13(12(3)19)10-15(14)18(20)21/h4-5,10-11H,6-9H2,1-3H3