1-[(4-nitrophenyl)methyl]-4-(4-pentylphenyl)-1,2,3-triazole

Systemtic Name: 1-[(4-nitrophenyl)methyl]-4-(4-pentylphenyl)-1,2,3-triazole Openeye Name: 1-[(4-nitrophenyl)methyl]-4-(4-pentylphenyl)triazole CAS Name: 1-[(4-nitrophenyl)methyl]-4-(4-pentylphenyl)triazole IUPAC Name: 1-[(4-nitrophenyl)methyl]-4-(4-pentylphenyl)triazole Traditional Name: 4-(4-amylphenyl)-1-(4-nitrobenzyl)triazole Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O2/c1-2-3-4-5-16-6-10-18(11-7-16)20-15-23(22-21-20)14-17-8-12-19(13-9-17)24(25)26/h6-13,15H,2-5,14H2,1H3