N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-1,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[4-(3,4-diethoxybenzyl)oxyphenyl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C23H26N4O6 MolecularWeight: 454.47574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=NN(C(=C3[N+](=O)[O-])C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=NN(C(=C3[N+](=O)[O-])C)C)OCC

InChI

InChI=1S/C23H26N4O6/c1-5-31-19-12-7-16(13-20(19)32-6-2)14-33-18-10-8-17(9-11-18)24-23(28)21-22(27(29)30)15(3)26(4)25-21/h7-13H,5-6,14H2,1-4H3,(H,24,28)