azane; 2-(methylamino)ethanesulfonic acid; 2-(2-oxidanylidenetridecylamino)ethanesulfonic acid

Systemtic Name: azane; 2-(methylamino)ethanesulfonic acid; 2-(2-oxidanylidenetridecylamino)ethanesulfonic acid Openeye Name: ammonia; 2-(methylamino)ethanesulfonic acid; 2-(2-oxotridecylamino)ethanesulfonic acid CAS Name: ammonia; 2-(methylamino)ethanesulfonic acid; 2-(2-oxotridecylamino)ethanesulfonic acid IUPAC Name: azane; 2-(methylamino)ethanesulfonic acid; 2-(2-oxotridecylamino)ethanesulfonic acid Traditional Name: ammonia; 2-(2-ketotridecylamino)ethanesulfonic acid; 2-(methylamino)ethanesulfonic acid Formula: C18H43N3O7S2 MolecularWeight: 477.67992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)CNCCS(=O)(=O)O.CNCCS(=O)(=O)O.N

Isomeric SMILES

CCCCCCCCCCCC(=O)CNCCS(=O)(=O)O.CNCCS(=O)(=O)O.N

InChI

InChI=1S/C15H31NO4S.C3H9NO3S.H3N/c1-2-3-4-5-6-7-8-9-10-11-15(17)14-16-12-13-21(18,19)20;1-4-2-3-8(5,6)7;/h16H,2-14H2,1H3,(H,18,19,20);4H,2-3H2,1H3,(H,5,6,7);1H3