5-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxo-pentanoic acid CAS Name: 5-[4-[(2,4-dichlorophenyl)methyl]-1-piperazinyl]-3-methyl-5-oxopentanoic acid IUPAC Name: 5-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxopentanoic acid Traditional Name: 5-[4-(2,4-dichlorobenzyl)piperazino]-5-keto-3-methyl-valeric acid Formula: C17H22Cl2N2O3 MolecularWeight: 373.27418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)Cl)Cl)CC(=O)O

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)Cl)Cl)CC(=O)O

InChI

InChI=1S/C17H22Cl2N2O3/c1-12(9-17(23)24)8-16(22)21-6-4-20(5-7-21)11-13-2-3-14(18)10-15(13)19/h2-3,10,12H,4-9,11H2,1H3,(H,23,24)