[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 3-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 3-(furan-2-ylcarbonylamino)propanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 3-(furan-2-carbonylamino)propanoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]propanoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 3-(furan-2-carbonylamino)propanoate Traditional Name: 3-(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:

C1CCCN(CC1)C(=O)COC(=O)CCNC(=O)C2=CC=CO2

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)CCNC(=O)C2=CC=CO2

InChI

InChI=1S/C16H22N2O5/c19-14(18-9-3-1-2-4-10-18)12-23-15(20)7-8-17-16(21)13-6-5-11-22-13/h5-6,11H,1-4,7-10,12H2,(H,17,21)