sodium 6-[3-(azepan-1-yl)propanoylamino]hexanoate

Systemtic Name: sodium 6-[3-(azepan-1-yl)propanoylamino]hexanoate Openeye Name: sodium 6-[3-(azepan-1-yl)propanoylamino]hexanoate CAS Name: sodium 6-[[3-(1-azepanyl)-1-oxopropyl]amino]hexanoate IUPAC Name: sodium 6-[3-(azepan-1-yl)propanoylamino]hexanoate Traditional Name: sodium 6-[3-(azepan-1-yl)propanoylamino]hexanoate Formula: C15H27N2NaO3 MolecularWeight: 306.37625

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCC(=O)NCCCCCC(=O)[O-].[Na+]

Isomeric SMILES

C1CCCN(CC1)CCC(=O)NCCCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C15H28N2O3.Na/c18-14(16-10-5-3-4-8-15(19)20)9-13-17-11-6-1-2-7-12-17;/h1-13H2,(H,16,18)(H,19,20);/q;+1/p-1