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

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]propionamide Formula: C19H15BrClN5O6 MolecularWeight: 524.7093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br)Cl

InChI

InChI=1S/C19H15BrClN5O6/c1-11-6-14(2-3-17(11)21)32-15-8-12(7-13(9-15)25(28)29)22-18(27)4-5-24-10-16(20)19(23-24)26(30)31/h2-3,6-10H,4-5H2,1H3,(H,22,27)