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

Systemtic Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: 5-isopropyl-4-nitro-N-[1-(o-tolylmethyl)pyrazol-4-yl]isoxazole-3-carboxamide CAS Name: N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-4-nitro-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: 5-isopropyl-N-[1-(2-methylbenzyl)pyrazol-4-yl]-4-nitro-isoxazole-3-carboxamide Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3[N+](=O)[O-])C(C)C

InChI

InChI=1S/C18H19N5O4/c1-11(2)17-16(23(25)26)15(21-27-17)18(24)20-14-8-19-22(10-14)9-13-7-5-4-6-12(13)3/h4-8,10-11H,9H2,1-3H3,(H,20,24)