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1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone

1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone

Systemtic Name:1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone
Openeye Name:1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone
CAS Name:1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone
IUPAC Name:1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone
Traditional Name:1-adamantyl-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone
Formula: C22H26ClN3O2
MolecularWeight: 399.91374
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=CC=C2Cl)C(=O)C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=CC=C2Cl)C(=O)C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C22H26ClN3O2/c1-2-7-28-21-24-19(17-5-3-4-6-18(17)23)26(25-21)20(27)22-11-14-8-15(12-22)10-16(9-14)13-22/h3-6,14-16H,2,7-13H2,1H3


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