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1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone

1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone

Systemtic Name:1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone
Openeye Name:1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone
CAS Name:1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone
IUPAC Name:1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone
Traditional Name:1-adamantyl-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)methanone
Formula: C22H27N3O2
MolecularWeight: 365.46868
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C22H27N3O2/c1-2-8-27-21-23-19(18-6-4-3-5-7-18)25(24-21)20(26)22-12-15-9-16(13-22)11-17(10-15)14-22/h3-7,15-17H,2,8-14H2,1H3


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