[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-thiophen-2-yl-methanone chloride

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-thiophen-2-yl-methanone chloride Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-thienyl)methanone chloride CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-thiophen-2-ylmethanone chloride IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-thiophen-2-ylmethanone chloride Traditional Name: (4-piperonylpiperazino)-(2-thienyl)methanone chloride Formula: C17H18ClN2O3S- MolecularWeight: 365.85442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CS4.[Cl-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CS4.[Cl-]

InChI

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