N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-3-(3-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-3-(3-nitropyrazol-1-yl)propionamide Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O4/c1-10(2)12-9-13(11(3)8-14(12)21)17-16(22)5-7-19-6-4-15(18-19)20(23)24/h4,6,8-10,21H,5,7H2,1-3H3,(H,17,22)