N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(4-tert-butylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c1-19(2,3)14-5-7-15(8-6-14)22-18(25)13-4-9-16(17(10-13)24(26)27)23-12-20-11-21-23/h4-12H,1-3H3,(H,22,25)