3-(propan-2-ylamino)-2-sulfo-propanoic acid

Systemtic Name: 3-(propan-2-ylamino)-2-sulfo-propanoic acid Openeye Name: 3-(isopropylamino)-2-sulfo-propanoic acid CAS Name: 3-(propan-2-ylamino)-2-sulfopropanoic acid IUPAC Name: 3-(propan-2-ylamino)-2-sulfopropanoic acid Traditional Name: 3-(isopropylamino)-2-sulfo-propionic acid Formula: C6H13NO5S MolecularWeight: 211.23612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(C)NCC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C6H13NO5S/c1-4(2)7-3-5(6(8)9)13(10,11)12/h4-5,7H,3H2,1-2H3,(H,8,9)(H,10,11,12)