(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(4-chloro-2,6-dimethyl-phenoxy)acetate CAS Name: 2-(4-chloro-2,6-dimethylphenoxy)acetic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(4-chloro-2,6-dimethylphenoxy)acetate Traditional Name: 2-(4-chloro-2,6-dimethyl-phenoxy)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H20ClN5O3 MolecularWeight: 413.8575

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C)Cl

InChI

InChI=1S/C20H20ClN5O3/c1-12-8-14(21)9-13(2)18(12)29-11-17(27)28-10-16-24-19(22)26-20(25-16)23-15-6-4-3-5-7-15/h3-9H,10-11H2,1-2H3,(H3,22,23,24,25,26)