3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazino]propionic acid Formula: C14H19ClN2O2 MolecularWeight: 282.76586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C14H19ClN2O2/c1-11-2-3-12(15)10-13(11)17-8-6-16(7-9-17)5-4-14(18)19/h2-3,10H,4-9H2,1H3,(H,18,19)