N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C21H26N6O6 MolecularWeight: 458.46774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C(C)N3C=C(C(=N3)OC)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C(C)N3C=C(C(=N3)OC)[N+](=O)[O-])OCC

InChI

InChI=1S/C21H26N6O6/c1-5-32-18-8-7-15(9-19(18)33-6-2)11-25-12-16(10-22-25)23-20(28)14(3)26-13-17(27(29)30)21(24-26)31-4/h7-10,12-14H,5-6,11H2,1-4H3,(H,23,28)