[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CN1CCCCCC1=O

Isomeric SMILES

C#CCNC(=O)COC(=O)CN1CCCCCC1=O

InChI

InChI=1S/C13H18N2O4/c1-2-7-14-11(16)10-19-13(18)9-15-8-5-3-4-6-12(15)17/h1H,3-10H2,(H,14,16)