3-[(2-oxidanylideneazocan-1-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 3-[(2-oxidanylideneazocan-1-yl)methyl]furan-2-carboxylic acid Openeye Name: 3-[(2-oxoazocan-1-yl)methyl]furan-2-carboxylic acid CAS Name: 3-[(2-oxo-1-azocanyl)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(2-oxoazocan-1-yl)methyl]furan-2-carboxylic acid Traditional Name: 3-[(2-ketoazocan-1-yl)methyl]-2-furoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(C(=O)CC1)CC2=C(OC=C2)C(=O)O

Isomeric SMILES

C1CCCN(C(=O)CC1)CC2=C(OC=C2)C(=O)O

InChI

InChI=1S/C13H17NO4/c15-11-5-3-1-2-4-7-14(11)9-10-6-8-18-12(10)13(16)17/h6,8H,1-5,7,9H2,(H,16,17)