2-[[4,6-bis[(4-ethoxyphenyl)amino]-1,3,5-triazin-2-yl]amino]ethanoate

Systemtic Name: 2-[[4,6-bis[(4-ethoxyphenyl)amino]-1,3,5-triazin-2-yl]amino]ethanoate Openeye Name: 2-[[4,6-bis(4-ethoxyanilino)-1,3,5-triazin-2-yl]amino]acetate CAS Name: 2-[[4,6-bis(4-ethoxyanilino)-1,3,5-triazin-2-yl]amino]acetate IUPAC Name: 2-[[4,6-bis(4-ethoxyanilino)-1,3,5-triazin-2-yl]amino]acetate Traditional Name: 2-[[4,6-bis(p-phenetidino)-s-triazin-2-yl]amino]acetate Formula: C21H23N6O4- MolecularWeight: 423.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=N2)NCC(=O)[O-])NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=N2)NCC(=O)[O-])NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H24N6O4/c1-3-30-16-9-5-14(6-10-16)23-20-25-19(22-13-18(28)29)26-21(27-20)24-15-7-11-17(12-8-15)31-4-2/h5-12H,3-4,13H2,1-2H3,(H,28,29)(H3,22,23,24,25,26,27)/p-1