2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]propanamide

Systemtic Name: 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]propanamide Openeye Name: N-[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-2-methyl-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-2-methyl-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]-2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C17H21N5O7 MolecularWeight: 407.37794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(C)C(=O)NC(CO)C(C2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC(C)C(=O)NC(CO)C(C2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O7/c1-10(8-20-11(2)7-15(19-20)22(28)29)17(25)18-14(9-23)16(24)12-3-5-13(6-4-12)21(26)27/h3-7,10,14,16,23-24H,8-9H2,1-2H3,(H,18,25)