N-(4-methoxy-2-nitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(4-methoxy-2-nitrophenyl)-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-3-(4-nitropyrazol-1-yl)propionamide Formula: C13H13N5O6 MolecularWeight: 335.27222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O6/c1-24-10-2-3-11(12(6-10)18(22)23)15-13(19)4-5-16-8-9(7-14-16)17(20)21/h2-3,6-8H,4-5H2,1H3,(H,15,19)