potassium; 2-azanylethanol; (E)-2-(2-azanyl-2-oxidanylidene-ethyl)-2-sulfo-icos-11-enoate

Systemtic Name: potassium; 2-azanylethanol; (E)-2-(2-azanyl-2-oxidanylidene-ethyl)-2-sulfo-icos-11-enoate Openeye Name: potassium; 2-aminoethanol; (E)-2-(2-amino-2-oxo-ethyl)-2-sulfo-icos-11-enoate CAS Name: potassium; 2-aminoethanol; (E)-2-(2-amino-2-oxoethyl)-2-sulfo-11-eicosenoate IUPAC Name: potassium; 2-aminoethanol; (E)-2-(2-amino-2-oxoethyl)-2-sulfoicos-11-enoate Traditional Name: potassium; 2-aminoethanol; (E)-2-(2-amino-2-keto-ethyl)-2-sulfo-eicos-11-enoate Formula: C24H47KN2O7S MolecularWeight: 546.80248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(CC(=O)N)(C(=O)[O-])S(=O)(=O)O.C(CO)N.[K+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC(CC(=O)N)(C(=O)[O-])S(=O)(=O)O.C(CO)N.[K+]

InChI

InChI=1S/C22H41NO6S.C2H7NO.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(21(25)26,19-20(23)24)30(27,28)29;3-1-2-4;/h9-10H,2-8,11-19H2,1H3,(H2,23,24)(H,25,26)(H,27,28,29);4H,1-3H2;/q;;+1/p-1/b10-9+;;