2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(3,4-diethoxybenzyl)oxyphenyl]acetamide Formula: C23H25BrN4O6 MolecularWeight: 533.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C)OCC

InChI

InChI=1S/C23H25BrN4O6/c1-4-32-19-11-6-16(12-20(19)33-5-2)14-34-18-9-7-17(8-10-18)25-21(29)13-27-15(3)22(24)23(26-27)28(30)31/h6-12H,4-5,13-14H2,1-3H3,(H,25,29)