[2-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate

Systemtic Name: [2-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate Openeye Name: [2-[5-chloro-2-(1,2,4-triazol-1-yl)anilino]-2-oxo-ethyl] (2R)-2-phenoxypropanoate CAS Name: (2R)-2-phenoxypropanoic acid [2-[5-chloro-2-(1,2,4-triazol-1-yl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[5-chloro-2-(1,2,4-triazol-1-yl)anilino]-2-oxoethyl] (2R)-2-phenoxypropanoate Traditional Name: (2R)-2-phenoxypropionic acid [2-[5-chloro-2-(1,2,4-triazol-1-yl)anilino]-2-keto-ethyl] ester Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=C(C=CC(=C1)Cl)N2C=NC=N2)OC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=C(C=CC(=C1)Cl)N2C=NC=N2)OC3=CC=CC=C3

InChI

InChI=1S/C19H17ClN4O4/c1-13(28-15-5-3-2-4-6-15)19(26)27-10-18(25)23-16-9-14(20)7-8-17(16)24-12-21-11-22-24/h2-9,11-13H,10H2,1H3,(H,23,25)/t13-/m1/s1