4-[(3S)-1-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]piperidin-1-ium-3-yl]morpholine

Systemtic Name: 4-[(3S)-1-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]piperidin-1-ium-3-yl]morpholine Openeye Name: 4-[(3S)-1-[[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]methyl]piperidin-1-ium-3-yl]morpholine CAS Name: 4-[(3S)-1-[[5-(1-piperidin-1-iumylmethyl)-2-thiophenyl]methyl]-3-piperidin-1-iumyl]morpholine IUPAC Name: 4-[(3S)-1-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]piperidin-1-ium-3-yl]morpholine Traditional Name: 4-[(3S)-1-[[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]methyl]piperidin-1-ium-3-yl]morpholine Formula: C20H35N3OS+2 MolecularWeight: 365.5764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(S2)C[NH+]3CCCC(C3)N4CCOCC4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(S2)C[NH+]3CCC[C@@H](C3)N4CCOCC4

InChI

InChI=1S/C20H33N3OS/c1-2-8-21(9-3-1)16-19-6-7-20(25-19)17-22-10-4-5-18(15-22)23-11-13-24-14-12-23/h6-7,18H,1-5,8-17H2/p+2/t18-/m0/s1