methyl 4-[(E)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethoxyiminomethyl]benzoate

Systemtic Name: methyl 4-[(E)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethoxyiminomethyl]benzoate Openeye Name: methyl 4-[(E)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethoxyiminomethyl]benzoate CAS Name: 4-[(E)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethoxyiminomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethoxyiminomethyl]benzoate Traditional Name: 4-[(E)-1-(4-amino-6-anilino-s-triazin-2-yl)ethyloximinomethyl]benzoic acid methyl ester Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)ON=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)O/N=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20N6O3/c1-13(29-22-12-14-8-10-15(11-9-14)18(27)28-2)17-24-19(21)26-20(25-17)23-16-6-4-3-5-7-16/h3-13H,1-2H3,(H3,21,23,24,25,26)/b22-12+