1-(4-dodecylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: 1-(4-dodecylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: 1-(4-dodecylphenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-dodecylphenyl)sulfonyl-2-pyrrolidinecarboxylate IUPAC Name: 1-(4-dodecylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-laurylphenyl)sulfonylpyrrolidine-2-carboxylate Formula: C23H36NO4S- MolecularWeight: 422.60124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)[O-]

InChI

InChI=1S/C23H37NO4S/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-21(18-16-20)29(27,28)24-19-12-14-22(24)23(25)26/h15-18,22H,2-14,19H2,1H3,(H,25,26)/p-1