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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)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-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl

InChI

InChI=1S/C19H18ClN5O3/c1-12-9-14(7-8-15(12)20)27-11-17(26)28-10-16-23-18(21)25-19(24-16)22-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H3,21,22,23,24,25)