N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylphenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylphenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-3-methyl-4-nitro-benzamide Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C)C3=NNC(=N3)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C)C3=NNC(=N3)C4CC4

InChI

InChI=1S/C20H19N5O3/c1-11-3-7-16(15(9-11)19-22-18(23-24-19)13-4-5-13)21-20(26)14-6-8-17(25(27)28)12(2)10-14/h3,6-10,13H,4-5H2,1-2H3,(H,21,26)(H,22,23,24)