(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-(4-chlorophenyl)propanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-(4-chlorophenyl)propanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-(4-chlorophenyl)propanoate CAS Name: 3-(4-chlorophenyl)propanoic 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 3-(4-chlorophenyl)propanoate Traditional Name: 3-(4-chlorophenyl)propionic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18ClN5O2 MolecularWeight: 383.83152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN5O2/c20-14-9-6-13(7-10-14)8-11-17(26)27-12-16-23-18(21)25-19(24-16)22-15-4-2-1-3-5-15/h1-7,9-10H,8,11-12H2,(H3,21,22,23,24,25)