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

Systemtic Name: 4-[[5-chloranyl-2-(2-diethylaminoethyloxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-chloro-2-(2-diethylaminoethyloxy)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[5-chloro-2-(2-diethylaminoethyloxy)phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[5-chloro-2-(2-diethylaminoethyloxy)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[5-chloro-2-(2-diethylaminoethyloxy)benzyl]amino]-4-keto-butyric acid Formula: C17H25ClN2O4 MolecularWeight: 356.8444

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)Cl)CNC(=O)CCC(=O)O

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)Cl)CNC(=O)CCC(=O)O

InChI

InChI=1S/C17H25ClN2O4/c1-3-20(4-2)9-10-24-15-6-5-14(18)11-13(15)12-19-16(21)7-8-17(22)23/h5-6,11H,3-4,7-10,12H2,1-2H3,(H,19,21)(H,22,23)