2-methyl-N-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-3-nitro-benzamide Openeye Name: 2-methyl-3-nitro-N-[5-(p-tolylmethyl)-1,3,4-oxadiazol-2-yl]benzamide CAS Name: 2-methyl-N-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[5-(4-methylbenzyl)-1,3,4-oxadiazol-2-yl]-3-nitro-benzamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H16N4O4/c1-11-6-8-13(9-7-11)10-16-20-21-18(26-16)19-17(23)14-4-3-5-15(12(14)2)22(24)25/h3-9H,10H2,1-2H3,(H,19,21,23)