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

Systemtic Name: 1-adamantyl-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone Openeye Name: 1-adamantyl-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone CAS Name: 1-adamantyl-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone IUPAC Name: 1-adamantyl-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone Traditional Name: 1-adamantyl-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]methanone Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3/c1-3-8-29-22-24-20(18-4-6-19(28-2)7-5-18)26(25-22)21(27)23-12-15-9-16(13-23)11-17(10-15)14-23/h4-7,15-17H,3,8-14H2,1-2H3