2-[4-(3-thiophen-2-ylpropyl)piperazin-1-yl]benzoic acid

Systemtic Name: 2-[4-(3-thiophen-2-ylpropyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-[3-(2-thienyl)propyl]piperazin-1-yl]benzoic acid CAS Name: 2-[4-(3-thiophen-2-ylpropyl)-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-(3-thiophen-2-ylpropyl)piperazin-1-yl]benzoic acid Traditional Name: 2-[4-[3-(2-thienyl)propyl]piperazino]benzoic acid Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CS2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CS2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H22N2O2S/c21-18(22)16-7-1-2-8-17(16)20-12-10-19(11-13-20)9-3-5-15-6-4-14-23-15/h1-2,4,6-8,14H,3,5,9-13H2,(H,21,22)