[2-(diethylamino)pyridin-1-ium-3-yl]methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-(diethylamino)pyridin-1-ium-3-yl]methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(diethylamino)pyridin-1-ium-3-yl]methyl-(3-thienylmethyl)ammonium CAS Name: [2-(diethylamino)-3-pyridin-1-iumyl]methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(diethylamino)pyridin-1-ium-3-yl]methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(diethylamino)pyridin-1-ium-3-yl]methyl-(3-thenyl)ammonium Formula: C15H23N3S+2 MolecularWeight: 277.42822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC=[NH+]1)C[NH2+]CC2=CSC=C2

Isomeric SMILES

CCN(CC)C1=C(C=CC=[NH+]1)C[NH2+]CC2=CSC=C2

InChI

InChI=1S/C15H21N3S/c1-3-18(4-2)15-14(6-5-8-17-15)11-16-10-13-7-9-19-12-13/h5-9,12,16H,3-4,10-11H2,1-2H3/p+2