2-(4-bromanylpyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(3-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(3-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)propionamide Formula: C13H13BrN4O4 MolecularWeight: 369.17072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC(=C1)OC)[N+](=O)[O-])N2C=C(C=N2)Br

Isomeric SMILES

CC(C(=O)NC1=CC(=CC(=C1)OC)[N+](=O)[O-])N2C=C(C=N2)Br

InChI

InChI=1S/C13H13BrN4O4/c1-8(17-7-9(14)6-15-17)13(19)16-10-3-11(18(20)21)5-12(4-10)22-2/h3-8H,1-2H3,(H,16,19)