4-[4-(2,4-dichlorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(2,4-dichlorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2,4-dichlorophenyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2,4-dichlorophenyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2,4-dichlorophenyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(2,4-dichlorophenyl)piperazino]-4-keto-butyric acid Formula: C14H16Cl2N2O3 MolecularWeight: 331.19444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)Cl)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)Cl)C(=O)CCC(=O)O

InChI

InChI=1S/C14H16Cl2N2O3/c15-10-1-2-12(11(16)9-10)17-5-7-18(8-6-17)13(19)3-4-14(20)21/h1-2,9H,3-8H2,(H,20,21)