1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Formula: C24H37N3O2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C24H37N3O2/c1-9-14-29-22-25-21(18-10-12-19(13-11-18)24(6,7)8)27(26-22)20(28)15-17(2)16-23(3,4)5/h10-13,17H,9,14-16H2,1-8H3