4-[[5-chloranyl-2-(2-phenoxyethoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-chloranyl-2-(2-phenoxyethoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-chloro-2-(2-phenoxyethoxy)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[5-chloro-2-(2-phenoxyethoxy)phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[5-chloro-2-(2-phenoxyethoxy)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[5-chloro-2-(2-phenoxyethoxy)benzyl]amino]-4-keto-butyric acid Formula: C19H20ClNO5 MolecularWeight: 377.8188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)CNC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)CNC(=O)CCC(=O)O

InChI

InChI=1S/C19H20ClNO5/c20-15-6-7-17(26-11-10-25-16-4-2-1-3-5-16)14(12-15)13-21-18(22)8-9-19(23)24/h1-7,12H,8-11,13H2,(H,21,22)(H,23,24)