(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-propan-2-yloxybenzoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-propan-2-yloxybenzoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-isopropoxybenzoate CAS Name: 4-propan-2-yloxybenzoic 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 4-propan-2-yloxybenzoate Traditional Name: 4-isopropoxybenzoic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C20H21N5O3/c1-13(2)28-16-10-8-14(9-11-16)18(26)27-12-17-23-19(21)25-20(24-17)22-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H3,21,22,23,24,25)