[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-(9-oxidanylideneacridin-10-yl)ethanoate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-(9-oxidanylideneacridin-10-yl)ethanoate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-(9-oxoacridin-10-yl)acetate CAS Name: 2-(9-oxo-10-acridinyl)acetic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-(9-oxoacridin-10-yl)acetate Traditional Name: 2-(9-ketoacridin-10-yl)acetic acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N)COC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N)COC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

InChI

InChI=1S/C21H20N6O3/c1-26(2)21-24-17(23-20(22)25-21)12-30-18(28)11-27-15-9-5-3-7-13(15)19(29)14-8-4-6-10-16(14)27/h3-10H,11-12H2,1-2H3,(H2,22,23,24,25)