N2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N2-ethyl-3-methyl-quinolin-1-ium-2,6-diamine

Systemtic Name: N2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N2-ethyl-3-methyl-quinolin-1-ium-2,6-diamine Openeye Name: N2-[(3S)-1,1-dioxothiolan-3-yl]-N2-ethyl-3-methyl-quinolin-1-ium-2,6-diamine CAS Name: N2-[(3S)-1,1-dioxo-3-thiolanyl]-N2-ethyl-3-methylquinolin-1-ium-2,6-diamine IUPAC Name: 2-N-[(3S)-1,1-dioxothiolan-3-yl]-2-N-ethyl-3-methylquinolin-1-ium-2,6-diamine Traditional Name: (6-amino-3-methyl-quinolin-1-ium-2-yl)-[(3S)-1,1-diketothiolan-3-yl]-ethyl-amine Formula: C16H22N3O2S+ MolecularWeight: 320.42978

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C2=C(C=C3C=C(C=CC3=[NH+]2)N)C

Isomeric SMILES

CCN([C@H]1CCS(=O)(=O)C1)C2=C(C=C3C=C(C=CC3=[NH+]2)N)C

InChI

InChI=1S/C16H21N3O2S/c1-3-19(14-6-7-22(20,21)10-14)16-11(2)8-12-9-13(17)4-5-15(12)18-16/h4-5,8-9,14H,3,6-7,10,17H2,1-2H3/p+1/t14-/m0/s1