sodium; 2-sulfobutanedioate; 1,2,3-tri(propan-2-yl)naphthalene

Systemtic Name: sodium; 2-sulfobutanedioate; 1,2,3-tri(propan-2-yl)naphthalene Openeye Name: sodium; 2-sulfobutanedioate; 1,2,3-triisopropylnaphthalene CAS Name: sodium; 2-sulfobutanedioate; 1,2,3-tri(propan-2-yl)naphthalene IUPAC Name: sodium; 2-sulfobutanedioate; 1,2,3-tri(propan-2-yl)naphthalene Traditional Name: sodium; 2-sulfosuccinate; 1,2,3-triisopropylnaphthalene Formula: C23H30NaO7S- MolecularWeight: 473.53487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)C(C)C.C(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)C(C)C.C(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H26.C4H6O7S.Na/c1-12(2)17-11-15-9-7-8-10-16(15)18(13(3)4)19(17)14(5)6;5-3(6)1-2(4(7)8)12(9,10)11;/h7-14H,1-6H3;2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);/q;;+1/p-2