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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(9-oxidanylideneacridin-10-yl)ethanoate Openeye Name: (4-amino-6-anilino-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-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-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-anilino-s-triazin-2-yl)methyl ester Formula: C25H20N6O3 MolecularWeight: 452.4647

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CN3C4=CC=CC=C4C(=O)C5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CN3C4=CC=CC=C4C(=O)C5=CC=CC=C53

InChI

InChI=1S/C25H20N6O3/c26-24-28-21(29-25(30-24)27-16-8-2-1-3-9-16)15-34-22(32)14-31-19-12-6-4-10-17(19)23(33)18-11-5-7-13-20(18)31/h1-13H,14-15H2,(H3,26,27,28,29,30)