2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[1-[(4-ethylphenoxy)methyl]-4-pyrazolyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]acetamide Formula: C18H19BrN6O4 MolecularWeight: 463.28526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C18H19BrN6O4/c1-3-13-4-6-15(7-5-13)29-11-23-9-14(8-20-23)21-16(26)10-24-12(2)17(19)18(22-24)25(27)28/h4-9H,3,10-11H2,1-2H3,(H,21,26)