[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone

Systemtic Name: [4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazino]-(2-methyl-3-nitro-phenyl)methanone Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H25N5O3/c1-4-23-13-16(15(3)20-23)12-21-8-10-22(11-9-21)19(25)17-6-5-7-18(14(17)2)24(26)27/h5-7,13H,4,8-12H2,1-3H3