methyl 5-(azepan-1-ylmethyl)furan-2-carboxylate

Systemtic Name: methyl 5-(azepan-1-ylmethyl)furan-2-carboxylate Openeye Name: methyl 5-(azepan-1-ylmethyl)furan-2-carboxylate CAS Name: 5-(1-azepanylmethyl)-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(azepan-1-ylmethyl)furan-2-carboxylate Traditional Name: 5-(azepan-1-ylmethyl)furan-2-carboxylic acid methyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2CCCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2CCCCCC2

InChI

InChI=1S/C13H19NO3/c1-16-13(15)12-7-6-11(17-12)10-14-8-4-2-3-5-9-14/h6-7H,2-5,8-10H2,1H3