[4-(azepan-1-ium-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(azepan-1-ium-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(azepan-1-ium-1-yl)-1-piperidyl]-(2-thienyl)methanone CAS Name: [4-(1-azepan-1-iumyl)-1-piperidinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(azepan-1-ium-1-yl)piperidin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(azepan-1-ium-1-yl)piperidino]-(2-thienyl)methanone Formula: C16H25N2OS+ MolecularWeight: 293.4475

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

C1CCC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C16H24N2OS/c19-16(15-6-5-13-20-15)18-11-7-14(8-12-18)17-9-3-1-2-4-10-17/h5-6,13-14H,1-4,7-12H2/p+1