4-[(3-chloranyl-5-ethoxy-4-hexoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-chloranyl-5-ethoxy-4-hexoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-chloro-5-ethoxy-4-hexoxy-phenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(3-chloro-5-ethoxy-4-hexoxyphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(3-chloro-5-ethoxy-4-hexoxyphenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(3-chloro-5-ethoxy-4-hexoxy-benzyl)amino]-4-keto-butyric acid Formula: C19H28ClNO5 MolecularWeight: 385.88232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)CNC(=O)CCC(=O)O)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)CNC(=O)CCC(=O)O)OCC

InChI

InChI=1S/C19H28ClNO5/c1-3-5-6-7-10-26-19-15(20)11-14(12-16(19)25-4-2)13-21-17(22)8-9-18(23)24/h11-12H,3-10,13H2,1-2H3,(H,21,22)(H,23,24)