6,6-dimethyl-1-[3-[(4-pentylphenoxy)methyl]phenyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6,6-dimethyl-1-[3-[(4-pentylphenoxy)methyl]phenyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6,6-dimethyl-1-[3-[(4-pentylphenoxy)methyl]phenyl]-1,3,5-triazine-2,4-diamine CAS Name: 6,6-dimethyl-1-[3-[(4-pentylphenoxy)methyl]phenyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6,6-dimethyl-1-[3-[(4-pentylphenoxy)methyl]phenyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-1-[3-[(4-amylphenoxy)methyl]phenyl]-6,6-dimethyl-s-triazin-2-yl]amine Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)OCC2=CC(=CC=C2)N3C(=NC(=NC3(C)C)N)N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)OCC2=CC(=CC=C2)N3C(=NC(=NC3(C)C)N)N

InChI

InChI=1S/C23H31N5O/c1-4-5-6-8-17-11-13-20(14-12-17)29-16-18-9-7-10-19(15-18)28-22(25)26-21(24)27-23(28,2)3/h7,9-15H,4-6,8,16H2,1-3H3,(H4,24,25,26,27)