[6-(4-heptoxyphenyl)pyridin-3-yl]-(3-oxidanylbenzotriazol-4-yl)methanone

Systemtic Name: [6-(4-heptoxyphenyl)pyridin-3-yl]-(3-oxidanylbenzotriazol-4-yl)methanone Openeye Name: [6-(4-heptoxyphenyl)-3-pyridyl]-(3-hydroxybenzotriazol-4-yl)methanone CAS Name: [6-(4-heptoxyphenyl)-3-pyridinyl]-(3-hydroxy-4-benzotriazolyl)methanone IUPAC Name: [6-(4-heptoxyphenyl)pyridin-3-yl]-(3-hydroxybenzotriazol-4-yl)methanone Traditional Name: [6-(4-heptoxyphenyl)-3-pyridyl]-(3-hydroxybenzotriazol-4-yl)methanone Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)C3=C4C(=CC=C3)N=NN4O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)C3=C4C(=CC=C3)N=NN4O

InChI

InChI=1S/C25H26N4O3/c1-2-3-4-5-6-16-32-20-13-10-18(11-14-20)22-15-12-19(17-26-22)25(30)21-8-7-9-23-24(21)29(31)28-27-23/h7-15,17,31H,2-6,16H2,1H3