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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COCC1=CC=CC(=C1)C(=O)OC)NC2=NC(=NC(=N2)N)C

Isomeric SMILES

CCC(COCC1=CC=CC(=C1)C(=O)OC)NC2=NC(=NC(=N2)N)C

InChI

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