[3-[3-(azepan-1-ium-1-yl)propoxy]thiophen-2-yl]methylazanium

Systemtic Name: [3-[3-(azepan-1-ium-1-yl)propoxy]thiophen-2-yl]methylazanium Openeye Name: [3-[3-(azepan-1-ium-1-yl)propoxy]-2-thienyl]methylammonium CAS Name: [3-[3-(1-azepan-1-iumyl)propoxy]-2-thiophenyl]methylammonium IUPAC Name: [3-[3-(azepan-1-ium-1-yl)propoxy]thiophen-2-yl]methylazanium Traditional Name: [3-[3-(azepan-1-ium-1-yl)propoxy]-2-thienyl]methylammonium Formula: C14H26N2OS+2 MolecularWeight: 270.43404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCOC2=C(SC=C2)C[NH3+]

Isomeric SMILES

C1CCC[NH+](CC1)CCCOC2=C(SC=C2)C[NH3+]

InChI

InChI=1S/C14H24N2OS/c15-12-14-13(6-11-18-14)17-10-5-9-16-7-3-1-2-4-8-16/h6,11H,1-5,7-10,12,15H2/p+2