N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-piperonylamide Formula: C24H21ClN4O3 MolecularWeight: 448.90154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H21ClN4O3/c1-2-3-4-15-5-8-17(9-6-15)29-27-20-12-18(25)19(13-21(20)28-29)26-24(30)16-7-10-22-23(11-16)32-14-31-22/h5-13H,2-4,14H2,1H3,(H,26,30)