2-(3-methyl-4-nitro-phenoxy)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: 2-(3-methyl-4-nitro-phenoxy)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-(3-methyl-4-nitro-phenoxy)-N-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]acetamide CAS Name: 2-(3-methyl-4-nitrophenoxy)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide IUPAC Name: 2-(3-methyl-4-nitrophenoxy)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide Traditional Name: N-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N5O4/c1-13-4-3-5-15(8-13)10-23-12-20-19(22-23)21-18(25)11-28-16-6-7-17(24(26)27)14(2)9-16/h3-9,12H,10-11H2,1-2H3,(H,21,22,25)