[(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl] 4-(4-methoxyphenoxy)butanoate

Systemtic Name: [(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl] 4-(4-methoxyphenoxy)butanoate Openeye Name: [(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl] 4-(4-methoxyphenoxy)butanoate CAS Name: 4-(4-methoxyphenoxy)butanoic acid [(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl] 4-(4-methoxyphenoxy)butanoate Traditional Name: 4-(4-methoxyphenoxy)butyric acid [(1R)-1-(4-amino-6-anilino-s-triazin-2-yl)ethyl] ester Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)OC(=O)CCCOC3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H](C1=NC(=NC(=N1)NC2=CC=CC=C2)N)OC(=O)CCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N5O4/c1-15(20-25-21(23)27-22(26-20)24-16-7-4-3-5-8-16)31-19(28)9-6-14-30-18-12-10-17(29-2)11-13-18/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3,(H3,23,24,25,26,27)/t15-/m1/s1