2-dodecylbenzenesulfonate; propan-2-amine

Systemtic Name: 2-dodecylbenzenesulfonate; propan-2-amine Openeye Name: 2-dodecylbenzenesulfonate; propan-2-amine CAS Name: 2-dodecylbenzenesulfonate; 2-propanamine IUPAC Name: 2-dodecylbenzenesulfonate; propan-2-amine Traditional Name: isopropylamine; 2-laurylbesylate Formula: C21H38NO3S- MolecularWeight: 384.59632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)N

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)N

InChI

InChI=1S/C18H30O3S.C3H9N/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-3(2)4/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);3H,4H2,1-2H3/p-1