3-oxidanylidene-3-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]propanoic acid Openeye Name: 3-oxo-3-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]propanoic acid CAS Name: 3-oxo-3-[4-(2,4,5-trimethylphenyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-oxo-3-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]propanoic acid Traditional Name: 3-keto-3-[4-(2,4,5-trimethylphenyl)piperazino]propionic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)N2CCN(CC2)C(=O)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)N2CCN(CC2)C(=O)CC(=O)O)C

InChI

InChI=1S/C16H22N2O3/c1-11-8-13(3)14(9-12(11)2)17-4-6-18(7-5-17)15(19)10-16(20)21/h8-9H,4-7,10H2,1-3H3,(H,20,21)