2-dodecylbenzenesulfonic acid; ethane-1,2-diamine

Systemtic Name: 2-dodecylbenzenesulfonic acid; ethane-1,2-diamine Openeye Name: 2-dodecylbenzenesulfonic acid; ethane-1,2-diamine CAS Name: 2-dodecylbenzenesulfonic acid; ethane-1,2-diamine IUPAC Name: 2-dodecylbenzenesulfonic acid; ethane-1,2-diamine Traditional Name: 2-aminoethylamine; 2-laurylbesylic acid Formula: C38H68N2O6S2 MolecularWeight: 713.08632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CN)N

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CN)N

InChI

InChI=1S/2C18H30O3S.C2H8N2/c2*1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;3-1-2-4/h2*12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);1-4H2