[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)propanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(furan-2-carbonylamino)propanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]propanoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(furan-2-carbonylamino)propanoate Traditional Name: 2-(2-furoylamino)propionic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N1CCCCCC1)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C(=O)OCC(=O)N1CCCCCC1)NC(=O)C2=CC=CO2

InChI

InChI=1S/C16H22N2O5/c1-12(17-15(20)13-7-6-10-22-13)16(21)23-11-14(19)18-8-4-2-3-5-9-18/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,17,20)