methyl (2S)-2-[(3-chloranyl-2-methyl-phenyl)carbamoylamino]-3,3,3-tris(fluoranyl)-2-phenoxy-propanoate

Systemtic Name: methyl (2S)-2-[(3-chloranyl-2-methyl-phenyl)carbamoylamino]-3,3,3-tris(fluoranyl)-2-phenoxy-propanoate Openeye Name: methyl (2S)-2-[(3-chloro-2-methyl-phenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxy-propanoate CAS Name: (2S)-2-[[(3-chloro-2-methylanilino)-oxomethyl]amino]-3,3,3-trifluoro-2-phenoxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-chloro-2-methylphenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate Traditional Name: (2S)-2-[(3-chloro-2-methyl-phenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxy-propionic acid methyl ester Formula: C18H16ClF3N2O4 MolecularWeight: 416.77885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)NC(C(=O)OC)(C(F)(F)F)OC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)N[C@](C(=O)OC)(C(F)(F)F)OC2=CC=CC=C2

InChI

InChI=1S/C18H16ClF3N2O4/c1-11-13(19)9-6-10-14(11)23-16(26)24-17(15(25)27-2,18(20,21)22)28-12-7-4-3-5-8-12/h3-10H,1-2H3,(H2,23,24,26)/t17-/m0/s1