(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic 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 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18ClN5O4 MolecularWeight: 415.83032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl)O

InChI

InChI=1S/C19H18ClN5O4/c1-2-28-14-9-11(8-13(20)16(14)26)17(27)29-10-15-23-18(21)25-19(24-15)22-12-6-4-3-5-7-12/h3-9,26H,2,10H2,1H3,(H3,21,22,23,24,25)