N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-5-isopropyl-4-nitro-isoxazole-3-carboxamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-4-nitro-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-5-isopropyl-4-nitro-isoxazole-3-carboxamide Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=NOC(=C3[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=NOC(=C3[N+](=O)[O-])C(C)C

InChI

InChI=1S/C19H21N5O4/c1-11(2)18-17(24(26)27)16(22-28-18)19(25)20-15-12(3)21-23(13(15)4)10-14-8-6-5-7-9-14/h5-9,11H,10H2,1-4H3,(H,20,25)