2-(octadecanoylamino)butanedioic acid

Systemtic Name: 2-(octadecanoylamino)butanedioic acid Openeye Name: 2-(octadecanoylamino)butanedioic acid CAS Name: 2-(1-oxooctadecylamino)butanedioic acid IUPAC Name: 2-(octadecanoylamino)butanedioic acid Traditional Name: 2-stearamidosuccinic acid Formula: C22H41NO5 MolecularWeight: 399.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C22H41NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19(22(27)28)18-21(25)26/h19H,2-18H2,1H3,(H,23,24)(H,25,26)(H,27,28)