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

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propionamide Formula: C19H16BrN5O7 MolecularWeight: 506.26364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H16BrN5O7/c1-31-14-2-4-15(5-3-14)32-16-9-12(8-13(10-16)24(27)28)21-18(26)6-7-23-11-17(20)19(22-23)25(29)30/h2-5,8-11H,6-7H2,1H3,(H,21,26)