2-(2-oxidanylidene-3-tetradecan-2-yl-azepan-1-yl)ethanoic acid

Systemtic Name: 2-(2-oxidanylidene-3-tetradecan-2-yl-azepan-1-yl)ethanoic acid Openeye Name: 2-[3-(1-methyltridecyl)-2-oxo-azepan-1-yl]acetic acid CAS Name: 2-(2-oxo-3-tetradecan-2-yl-1-azepanyl)acetic acid IUPAC Name: 2-(2-oxo-3-tetradecan-2-ylazepan-1-yl)acetic acid Traditional Name: 2-[2-keto-3-(1-methyltridecyl)azepan-1-yl]acetic acid Formula: C22H41NO3 MolecularWeight: 367.56584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C1CCCCN(C1=O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(C)C1CCCCN(C1=O)CC(=O)O

InChI

InChI=1S/C22H41NO3/c1-3-4-5-6-7-8-9-10-11-12-15-19(2)20-16-13-14-17-23(22(20)26)18-21(24)25/h19-20H,3-18H2,1-2H3,(H,24,25)