cyclohexanamine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid

Systemtic Name: cyclohexanamine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid Openeye Name: cyclohexanamine; 2,3-diisopropylnaphthalene-1-sulfonic acid CAS Name: cyclohexanamine; 2,3-di(propan-2-yl)-1-naphthalenesulfonic acid IUPAC Name: cyclohexanamine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid Traditional Name: cyclohexylamine; 2,3-diisopropylnaphthalene-1-sulfonic acid Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)S(=O)(=O)O.C1CCC(CC1)N

Isomeric SMILES

CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)S(=O)(=O)O.C1CCC(CC1)N

InChI

InChI=1S/C16H20O3S.C6H13N/c1-10(2)14-9-12-7-5-6-8-13(12)16(20(17,18)19)15(14)11(3)4;7-6-4-2-1-3-5-6/h5-11H,1-4H3,(H,17,18,19);6H,1-5,7H2