1-[3-propan-2-yloxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]tetradecan-1-one

Systemtic Name: 1-[3-propan-2-yloxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]tetradecan-1-one Openeye Name: 1-[3-isopropoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]tetradecan-1-one CAS Name: 1-[3-propan-2-yloxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-1-tetradecanone IUPAC Name: 1-[3-propan-2-yloxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]tetradecan-1-one Traditional Name: 1-[3-isopropoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]tetradecan-1-one Formula: C28H45N3O5 MolecularWeight: 503.674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OC(C)C)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OC(C)C)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C28H45N3O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-25(32)31-27(29-28(30-31)36-21(2)3)22-19-23(33-4)26(35-6)24(20-22)34-5/h19-21H,7-18H2,1-6H3