[2-(6-octoxypyridin-3-yl)-1,3-benzoxazol-5-yl]-(3-oxidanylbenzotriazol-4-yl)methanone

Systemtic Name: [2-(6-octoxypyridin-3-yl)-1,3-benzoxazol-5-yl]-(3-oxidanylbenzotriazol-4-yl)methanone Openeye Name: (3-hydroxybenzotriazol-4-yl)-[2-(6-octoxy-3-pyridyl)-1,3-benzoxazol-5-yl]methanone CAS Name: (3-hydroxy-4-benzotriazolyl)-[2-(6-octoxy-3-pyridinyl)-1,3-benzoxazol-5-yl]methanone IUPAC Name: (3-hydroxybenzotriazol-4-yl)-[2-(6-octoxypyridin-3-yl)-1,3-benzoxazol-5-yl]methanone Traditional Name: (3-hydroxybenzotriazol-4-yl)-[2-(6-octoxy-3-pyridyl)-1,3-benzoxazol-5-yl]methanone Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)C4=C5C(=CC=C4)N=NN5O

Isomeric SMILES

CCCCCCCCOC1=NC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)C4=C5C(=CC=C4)N=NN5O

InChI

InChI=1S/C27H27N5O4/c1-2-3-4-5-6-7-15-35-24-14-12-19(17-28-24)27-29-22-16-18(11-13-23(22)36-27)26(33)20-9-8-10-21-25(20)32(34)31-30-21/h8-14,16-17,34H,2-7,15H2,1H3