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

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C20H24N6O5 MolecularWeight: 428.44176

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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)[N+](=O)[O-])OCC

Isomeric SMILES

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

InChI

InChI=1S/C20H24N6O5/c1-4-30-18-7-6-15(8-19(18)31-5-2)11-24-12-16(9-21-24)23-20(27)14(3)25-13-17(10-22-25)26(28)29/h6-10,12-14H,4-5,11H2,1-3H3,(H,23,27)