methyl 2-[2-chloranyl-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[2-chloranyl-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]ethanoate Openeye Name: methyl 2-[2-chloro-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]acetate CAS Name: 2-[2-chloro-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-chloro-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]acetate Traditional Name: 2-[2-chloro-6-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]acetic acid methyl ester Formula: C13H15ClN4O4 MolecularWeight: 326.7356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC(=O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC(=O)OC

InChI

InChI=1S/C13H15ClN4O4/c1-20-10-4-8(5-15-13-16-7-17-18-13)3-9(14)12(10)22-6-11(19)21-2/h3-4,7H,5-6H2,1-2H3,(H2,15,16,17,18)