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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(2-nitrophenoxy)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)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-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C18H16N6O5 MolecularWeight: 396.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O5/c19-17-21-15(22-18(23-17)20-12-6-2-1-3-7-12)10-29-16(25)11-28-14-9-5-4-8-13(14)24(26)27/h1-9H,10-11H2,(H3,19,20,21,22,23)