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

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-5-isopropyl-4-nitro-isoxazole-3-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]-4-nitro-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-5-methyl-pyrazol-3-yl]-5-isopropyl-4-nitro-isoxazole-3-carboxamide Formula: C18H18ClN5O4 MolecularWeight: 403.81962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN5O4/c1-10(2)17-16(24(26)27)15(22-28-17)18(25)20-14-8-11(3)23(21-14)9-12-4-6-13(19)7-5-12/h4-8,10H,9H2,1-3H3,(H,20,21,25)