methyl 2-[2-[(4-azanyl-6-methyl-1,3,5-triazin-2-yl)amino]butoxymethyl]benzoate

Systemtic Name: methyl 2-[2-[(4-azanyl-6-methyl-1,3,5-triazin-2-yl)amino]butoxymethyl]benzoate Openeye Name: methyl 2-[2-[(4-amino-6-methyl-1,3,5-triazin-2-yl)amino]butoxymethyl]benzoate CAS Name: 2-[2-[(4-amino-6-methyl-1,3,5-triazin-2-yl)amino]butoxymethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[(4-amino-6-methyl-1,3,5-triazin-2-yl)amino]butoxymethyl]benzoate Traditional Name: 2-[2-[(4-amino-6-methyl-s-triazin-2-yl)amino]butoxymethyl]benzoic acid methyl ester Formula: C17H23N5O3 MolecularWeight: 345.39622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COCC1=CC=CC=C1C(=O)OC)NC2=NC(=NC(=N2)N)C

Isomeric SMILES

CCC(COCC1=CC=CC=C1C(=O)OC)NC2=NC(=NC(=N2)N)C

InChI

InChI=1S/C17H23N5O3/c1-4-13(21-17-20-11(2)19-16(18)22-17)10-25-9-12-7-5-6-8-14(12)15(23)24-3/h5-8,13H,4,9-10H2,1-3H3,(H3,18,19,20,21,22)