[3-[(2R)-4-(azepan-1-ium-1-yl)butan-2-yl]oxythiophen-2-yl]methylazanium

Systemtic Name: [3-[(2R)-4-(azepan-1-ium-1-yl)butan-2-yl]oxythiophen-2-yl]methylazanium Openeye Name: [3-[(1R)-3-(azepan-1-ium-1-yl)-1-methyl-propoxy]-2-thienyl]methylammonium CAS Name: [3-[(2R)-4-(1-azepan-1-iumyl)butan-2-yl]oxy-2-thiophenyl]methylammonium IUPAC Name: [3-[(2R)-4-(azepan-1-ium-1-yl)butan-2-yl]oxythiophen-2-yl]methylazanium Traditional Name: [3-[(1R)-3-(azepan-1-ium-1-yl)-1-methyl-propoxy]-2-thienyl]methylammonium Formula: C15H28N2OS+2 MolecularWeight: 284.46062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[NH+]1CCCCCC1)OC2=C(SC=C2)C[NH3+]

Isomeric SMILES

C[C@H](CC[NH+]1CCCCCC1)OC2=C(SC=C2)C[NH3+]

InChI

InChI=1S/C15H26N2OS/c1-13(18-14-7-11-19-15(14)12-16)6-10-17-8-4-2-3-5-9-17/h7,11,13H,2-6,8-10,12,16H2,1H3/p+2/t13-/m1/s1