[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 4-butoxybenzoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 4-butoxybenzoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C15H19N5O3/c1-2-3-8-22-11-6-4-10(5-7-11)13(21)23-9-12-18-14(16)20-15(17)19-12/h4-7H,2-3,8-9H2,1H3,(H4,16,17,18,19,20)