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

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H24N4O3/c1-2-3-4-17-5-9-20(10-6-17)29-27-21-11-8-19(16-22(21)28-29)26-25(30)18-7-12-23-24(15-18)32-14-13-31-23/h5-12,15-16H,2-4,13-14H2,1H3,(H,26,30)