2-[3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]ethanoic acid

Systemtic Name: 2-[3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]ethanoic acid Openeye Name: 2-[3-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]acetic acid CAS Name: 2-[3-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]acetic acid IUPAC Name: 2-[3-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]acetic acid Traditional Name: 2-[3-[4-(2-thenoyl)piperazino]phenyl]acetic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)CC(=O)O)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)CC(=O)O)C(=O)C3=CC=CS3

InChI

InChI=1S/C17H18N2O3S/c20-16(21)12-13-3-1-4-14(11-13)18-6-8-19(9-7-18)17(22)15-5-2-10-23-15/h1-5,10-11H,6-9,12H2,(H,20,21)