3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(4-isopropylbenzyl)piperazino]propionic acid Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C17H26N2O2/c1-14(2)16-5-3-15(4-6-16)13-19-11-9-18(10-12-19)8-7-17(20)21/h3-6,14H,7-13H2,1-2H3,(H,20,21)