sodium N-[2,6-di(propan-2-yl)phenyl]-N'-dodecoxysulfonyl-carbamimidate

Systemtic Name: sodium N-[2,6-di(propan-2-yl)phenyl]-N'-dodecoxysulfonyl-carbamimidate Openeye Name: sodium N-(2,6-diisopropylphenyl)-N'-dodecoxysulfonyl-carbamimidate CAS Name: sodium N-[2,6-di(propan-2-yl)phenyl]-N'-dodecoxysulfonylcarbamimidate IUPAC Name: sodium N-[2,6-di(propan-2-yl)phenyl]-N'-dodecoxysulfonylcarbamimidate Traditional Name: sodium N-(2,6-diisopropylphenyl)-N'-lauryloxysulfonyl-carbamimidate Formula: C25H43N2NaO4S MolecularWeight: 490.67469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)N=C(NC1=C(C=CC=C1C(C)C)C(C)C)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)/N=C(/NC1=C(C=CC=C1C(C)C)C(C)C)\[O-].[Na+]

InChI

InChI=1S/C25H44N2O4S.Na/c1-6-7-8-9-10-11-12-13-14-15-19-31-32(29,30)27-25(28)26-24-22(20(2)3)17-16-18-23(24)21(4)5;/h16-18,20-21H,6-15,19H2,1-5H3,(H2,26,27,28);/q;+1/p-1