2-azanylethanol; 4-hexadecoxy-4-oxidanylidene-2-sulfo-butanoic acid

Systemtic Name: 2-azanylethanol; 4-hexadecoxy-4-oxidanylidene-2-sulfo-butanoic acid Openeye Name: 2-aminoethanol; 4-hexadecoxy-4-oxo-2-sulfo-butanoic acid CAS Name: 2-aminoethanol; 4-hexadecoxy-4-oxo-2-sulfobutanoic acid IUPAC Name: 2-aminoethanol; 4-hexadecoxy-4-oxo-2-sulfobutanoic acid Traditional Name: 2-aminoethanol; 4-cetyloxy-4-keto-2-sulfo-butyric acid Formula: C24H52N2O9S MolecularWeight: 544.74268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)O.C(CO)N.C(CO)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)O.C(CO)N.C(CO)N

InChI

InChI=1S/C20H38O7S.2C2H7NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-27-19(21)17-18(20(22)23)28(24,25)26;2*3-1-2-4/h18H,2-17H2,1H3,(H,22,23)(H,24,25,26);2*4H,1-3H2