8-aminocarbonyl-12-butanoyloxy-heptadecanoic acid

Systemtic Name: 8-aminocarbonyl-12-butanoyloxy-heptadecanoic acid Openeye Name: 12-butanoyloxy-8-carbamoyl-heptadecanoic acid CAS Name: 8-carbamoyl-12-(1-oxobutoxy)heptadecanoic acid IUPAC Name: 12-butanoyloxy-8-carbamoylheptadecanoic acid Traditional Name: 12-butyryloxy-8-carbamoyl-heptadecanoic acid Formula: C22H41NO5 MolecularWeight: 399.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)O)C(=O)N)OC(=O)CCC

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)O)C(=O)N)OC(=O)CCC

InChI

InChI=1S/C22H41NO5/c1-3-5-8-15-19(28-21(26)12-4-2)16-11-14-18(22(23)27)13-9-6-7-10-17-20(24)25/h18-19H,3-17H2,1-2H3,(H2,23,27)(H,24,25)