N-[4-[5-(4-bromophenyl)-1,2,3-triazol-1-yl]phenyl]-4-butoxy-benzamide

Systemtic Name: N-[4-[5-(4-bromophenyl)-1,2,3-triazol-1-yl]phenyl]-4-butoxy-benzamide Openeye Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-4-butoxy-benzamide CAS Name: N-[4-[5-(4-bromophenyl)-1-triazolyl]phenyl]-4-butoxybenzamide IUPAC Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-4-butoxybenzamide Traditional Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-4-butoxy-benzamide Formula: C25H23BrN4O2 MolecularWeight: 491.37972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H23BrN4O2/c1-2-3-16-32-23-14-6-19(7-15-23)25(31)28-21-10-12-22(13-11-21)30-24(17-27-29-30)18-4-8-20(26)9-5-18/h4-15,17H,2-3,16H2,1H3,(H,28,31)