dimethyl-[(1S)-2-[(1-propylpiperidin-1-ium-4-yl)amino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(1-propylpiperidin-1-ium-4-yl)amino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(1-propylpiperidin-1-ium-4-yl)amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[(1-propyl-4-piperidin-1-iumyl)amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(1-propylpiperidin-1-ium-4-yl)amino]-1-thiophen-2-ylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[(1-propylpiperidin-1-ium-4-yl)amino]-1-(2-thienyl)ethyl]ammonium Formula: C16H31N3S+2 MolecularWeight: 297.50244

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC(C2=CC=CS2)[NH+](C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC[C@@H](C2=CC=CS2)[NH+](C)C

InChI

InChI=1S/C16H29N3S/c1-4-9-19-10-7-14(8-11-19)17-13-15(18(2)3)16-6-5-12-20-16/h5-6,12,14-15,17H,4,7-11,13H2,1-3H3/p+2/t15-/m0/s1