3-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)propanoate

Systemtic Name: 3-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)propanoate Openeye Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)propanoate CAS Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)propanoate IUPAC Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)propanoate Traditional Name: 3-(4-amino-6-anilino-s-triazin-2-yl)propionate Formula: C12H12N5O2- MolecularWeight: 258.25598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CCC(=O)[O-]

InChI

InChI=1S/C12H13N5O2/c13-11-15-9(6-7-10(18)19)16-12(17-11)14-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,18,19)(H3,13,14,15,16,17)/p-1