13-[4-(5-pyridin-2-yl-1H-pyrazol-3-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

Systemtic Name: 13-[4-(5-pyridin-2-yl-1H-pyrazol-3-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Openeye Name: 13-[4-[5-(2-pyridyl)-1H-pyrazol-3-yl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane CAS Name: 13-[4-[5-(2-pyridinyl)-1H-pyrazol-3-yl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane IUPAC Name: 13-[4-(5-pyridin-2-yl-1H-pyrazol-3-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Traditional Name: 13-[4-[5-(2-pyridyl)-1H-pyrazol-3-yl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCCOCCN1C2=CC=C(C=C2)C3=NNC(=C3)C4=CC=CC=N4

Isomeric SMILES

C1COCCOCCOCCOCCN1C2=CC=C(C=C2)C3=NNC(=C3)C4=CC=CC=N4

InChI

InChI=1S/C24H30N4O4/c1-2-8-25-22(3-1)24-19-23(26-27-24)20-4-6-21(7-5-20)28-9-11-29-13-15-31-17-18-32-16-14-30-12-10-28/h1-8,19H,9-18H2,(H,26,27)