1-nitro-N,N-dioctadecyl-cyclohexa-2,4-diene-1-sulfonamide

Systemtic Name: 1-nitro-N,N-dioctadecyl-cyclohexa-2,4-diene-1-sulfonamide Openeye Name: 1-nitro-N,N-dioctadecyl-cyclohexa-2,4-diene-1-sulfonamide CAS Name: 1-nitro-N,N-dioctadecyl-1-cyclohexa-2,4-dienesulfonamide IUPAC Name: 1-nitro-N,N-dioctadecylcyclohexa-2,4-diene-1-sulfonamide Traditional Name: 1-nitro-N,N-distearyl-cyclohexa-2,4-diene-1-sulfonamide Formula: C42H80N2O4S MolecularWeight: 709.1606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)S(=O)(=O)C1(CC=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)S(=O)(=O)C1(CC=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C42H80N2O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36-40-43(49(47,48)42(44(45)46)38-34-33-35-39-42)41-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-35,38H,3-32,36-37,39-41H2,1-2H3