5-(azocan-1-ylmethyl)-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-(azocan-1-ylmethyl)-2-methyl-furan-3-carboxylic acid Openeye Name: 5-(azocan-1-ylmethyl)-2-methyl-furan-3-carboxylic acid CAS Name: 5-(1-azocanylmethyl)-2-methyl-3-furancarboxylic acid IUPAC Name: 5-(azocan-1-ylmethyl)-2-methylfuran-3-carboxylic acid Traditional Name: 5-(azocan-1-ylmethyl)-2-methyl-3-furoic acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2CCCCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CN2CCCCCCC2)C(=O)O

InChI

InChI=1S/C14H21NO3/c1-11-13(14(16)17)9-12(18-11)10-15-7-5-3-2-4-6-8-15/h9H,2-8,10H2,1H3,(H,16,17)