3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)propionamide Formula: C16H19BrN4O4 MolecularWeight: 411.25046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C16H19BrN4O4/c1-9(2)11-7-13(10(3)6-14(11)22)18-15(23)4-5-20-8-12(17)16(19-20)21(24)25/h6-9,22H,4-5H2,1-3H3,(H,18,23)