N2-tert-butyl-6-chloranyl-N4-ethyl-1,3,5-triazine-2,4-diamine; 2-(phosphonomethylamino)ethanoic acid

Systemtic Name: N2-tert-butyl-6-chloranyl-N4-ethyl-1,3,5-triazine-2,4-diamine; 2-(phosphonomethylamino)ethanoic acid Openeye Name: N2-tert-butyl-6-chloro-N4-ethyl-1,3,5-triazine-2,4-diamine; 2-(phosphonomethylamino)acetic acid CAS Name: N2-tert-butyl-6-chloro-N4-ethyl-1,3,5-triazine-2,4-diamine; 2-(phosphonomethylamino)acetic acid IUPAC Name: 2-N-tert-butyl-6-chloro-4-N-ethyl-1,3,5-triazine-2,4-diamine; 2-(phosphonomethylamino)acetic acid Traditional Name: tert-butyl-[4-chloro-6-(ethylamino)-s-triazin-2-yl]amine; 2-(phosphonomethylamino)acetic acid Formula: C12H24ClN6O5P MolecularWeight: 398.782921

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C.C(C(=O)O)NCP(=O)(O)O

Isomeric SMILES

CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C.C(C(=O)O)NCP(=O)(O)O

InChI

InChI=1S/C9H16ClN5.C3H8NO5P/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4;5-3(6)1-4-2-10(7,8)9/h5H2,1-4H3,(H2,11,12,13,14,15);4H,1-2H2,(H,5,6)(H2,7,8,9)