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

Systemtic Name: N-[2-(4-chlorophenyl)-6-methyl-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(4-chlorophenyl)-6-methyl-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(4-chlorophenyl)-6-methyl-5-benzotriazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(4-chlorophenyl)-6-methylbenzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(4-chlorophenyl)-6-methyl-benzotriazol-5-yl]-piperonylamide Formula: C21H15ClN4O3 MolecularWeight: 406.8218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H15ClN4O3/c1-12-8-17-18(25-26(24-17)15-5-3-14(22)4-6-15)10-16(12)23-21(27)13-2-7-19-20(9-13)29-11-28-19/h2-10H,11H2,1H3,(H,23,27)