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

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

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c1-2-3-4-14-5-8-16(9-6-14)22-19(25)15-7-10-17(18(11-15)24(26)27)23-13-20-12-21-23/h5-13H,2-4H2,1H3,(H,22,25)