ethanoic acid; N6-heptyl-4,4-dimethyl-N2-[(4-methylphenyl)methyl]-1H-1,3,5-triazine-2,6-diamine

Systemtic Name: ethanoic acid; N6-heptyl-4,4-dimethyl-N2-[(4-methylphenyl)methyl]-1H-1,3,5-triazine-2,6-diamine Openeye Name: acetic acid; N6-heptyl-4,4-dimethyl-N2-(p-tolylmethyl)-1H-1,3,5-triazine-2,6-diamine CAS Name: acetic acid; N6-heptyl-4,4-dimethyl-N2-[(4-methylphenyl)methyl]-1H-1,3,5-triazine-2,6-diamine IUPAC Name: acetic acid; 6-N-heptyl-4,4-dimethyl-2-N-[(4-methylphenyl)methyl]-1H-1,3,5-triazine-2,6-diamine Traditional Name: acetic acid; [4,4-dimethyl-6-[(4-methylbenzyl)amino]-1H-s-triazin-2-yl]-heptyl-amine Formula: C22H37N5O2 MolecularWeight: 403.56148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=NC(N=C(N1)NCC2=CC=C(C=C2)C)(C)C.CC(=O)O

Isomeric SMILES

CCCCCCCNC1=NC(N=C(N1)NCC2=CC=C(C=C2)C)(C)C.CC(=O)O

InChI

InChI=1S/C20H33N5.C2H4O2/c1-5-6-7-8-9-14-21-18-23-19(25-20(3,4)24-18)22-15-17-12-10-16(2)11-13-17;1-2(3)4/h10-13H,5-9,14-15H2,1-4H3,(H3,21,22,23,24,25);1H3,(H,3,4)