3-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-2-nitro-benzamide

Systemtic Name: 3-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-2-nitro-benzamide Openeye Name: 3-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-2-nitro-benzamide CAS Name: 3-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-2-nitrobenzamide IUPAC Name: 3-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-2-nitrobenzamide Traditional Name: 3-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-2-nitro-benzamide Formula: C17H14BrN5O3 MolecularWeight: 416.22876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC3=CC=CC(=C3[N+](=O)[O-])C(=O)N)Br

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC3=CC=CC(=C3[N+](=O)[O-])C(=O)N)Br

InChI

InChI=1S/C17H14BrN5O3/c1-22-9-13(18)15(21-22)10-4-2-5-11(8-10)20-14-7-3-6-12(17(19)24)16(14)23(25)26/h2-9,20H,1H3,(H2,19,24)