3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine

Systemtic Name: 3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine Openeye Name: 3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine CAS Name: 3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine IUPAC Name: 3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine Traditional Name: 3-(4,4-dimethylpentyl)-5,6-bis(4-propoxyphenyl)-1,2,4-triazine Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C(N=NC(=N2)CCCC(C)(C)C)C3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C(N=NC(=N2)CCCC(C)(C)C)C3=CC=C(C=C3)OCCC

InChI

InChI=1S/C28H37N3O2/c1-6-19-32-23-14-10-21(11-15-23)26-27(22-12-16-24(17-13-22)33-20-7-2)31-30-25(29-26)9-8-18-28(3,4)5/h10-17H,6-9,18-20H2,1-5H3