3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-cyclohexyl-benzamide

Systemtic Name: 3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-cyclohexyl-benzamide Openeye Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-cyclohexyl-benzamide CAS Name: 3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-cyclohexylbenzamide IUPAC Name: 3-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-cyclohexylbenzamide Traditional Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-cyclohexyl-benzamide Formula: C17H19BrN4O3 MolecularWeight: 407.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H19BrN4O3/c18-15-11-21(20-16(15)22(24)25)10-12-5-4-6-13(9-12)17(23)19-14-7-2-1-3-8-14/h4-6,9,11,14H,1-3,7-8,10H2,(H,19,23)