[2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-oxidanylbenzotriazol-4-yl)methanone

Systemtic Name: [2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-oxidanylbenzotriazol-4-yl)methanone Openeye Name: [2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-hydroxybenzotriazol-4-yl)methanone CAS Name: [2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-hydroxy-4-benzotriazolyl)methanone IUPAC Name: [2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-hydroxybenzotriazol-4-yl)methanone Traditional Name: [2-(4-hexoxyphenyl)-3H-benzimidazol-5-yl]-(3-hydroxybenzotriazol-4-yl)methanone Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)C4=C5C(=CC=C4)N=NN5O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)C4=C5C(=CC=C4)N=NN5O

InChI

InChI=1S/C26H25N5O3/c1-2-3-4-5-15-34-19-12-9-17(10-13-19)26-27-21-14-11-18(16-23(21)28-26)25(32)20-7-6-8-22-24(20)31(33)30-29-22/h6-14,16,33H,2-5,15H2,1H3,(H,27,28)