ethyl 2-azanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]benzoate hydrochloride

Systemtic Name: ethyl 2-azanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]benzoate hydrochloride Openeye Name: ethyl 2-amino-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate hydrochloride CAS Name: 2-amino-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-amino-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate hydrochloride Traditional Name: 2-amino-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoic acid ethyl ester hydrochloride Formula: C16H14Cl2F3NO3 MolecularWeight: 396.18847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)N.Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)N.Cl

InChI

InChI=1S/C16H13ClF3NO3.ClH/c1-2-23-15(22)11-8-10(4-5-13(11)21)24-14-6-3-9(7-12(14)17)16(18,19)20;/h3-8H,2,21H2,1H3;1H