octadecanamide; propane-1-sulfonic acid

Systemtic Name: octadecanamide; propane-1-sulfonic acid Openeye Name: octadecanamide; propane-1-sulfonic acid CAS Name: octadecanamide; 1-propanesulfonic acid IUPAC Name: octadecanamide; propane-1-sulfonic acid Traditional Name: propane-1-sulfonic acid; stearamide Formula: C21H45NO4S MolecularWeight: 407.6513

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N.CCCS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N.CCCS(=O)(=O)O

InChI

InChI=1S/C18H37NO.C3H8O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-7(4,5)6/h2-17H2,1H3,(H2,19,20);2-3H2,1H3,(H,4,5,6)