N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-3-(3-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-3-(3-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C20H19N5O7 MolecularWeight: 441.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O7/c1-13-17(25(29)30)12-23(22-13)8-7-20(26)21-14-9-15(24(27)28)11-16(10-14)32-19-6-4-3-5-18(19)31-2/h3-6,9-12H,7-8H2,1-2H3,(H,21,26)