[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 3-chloro-4-isopropoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propan-2-yloxybenzoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 3-chloro-5-methoxy-4-propan-2-yloxybenzoate Traditional Name: 3-chloro-4-isopropoxy-5-methoxy-benzoic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C15H18ClN5O4 MolecularWeight: 367.78752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=NC(=N2)N)N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=NC(=N2)N)N)OC

InChI

InChI=1S/C15H18ClN5O4/c1-7(2)25-12-9(16)4-8(5-10(12)23-3)13(22)24-6-11-19-14(17)21-15(18)20-11/h4-5,7H,6H2,1-3H3,(H4,17,18,19,20,21)