(phenylmethyl) 9-oxidanylidene-1-oxa-4-azacyclonon-5-yne-4-carboxylate

Systemtic Name: (phenylmethyl) 9-oxidanylidene-1-oxa-4-azacyclonon-5-yne-4-carboxylate Openeye Name: benzyl 9-oxo-1-oxa-4-azacyclonon-5-yne-4-carboxylate CAS Name: 9-oxo-1-oxa-4-azacyclonon-5-yne-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-oxo-1-oxa-4-azacyclonon-5-yne-4-carboxylate Traditional Name: 9-keto-1-oxa-4-azacyclonon-5-yne-4-carboxylic acid benzyl ester Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OCCN(C#C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(=O)OCCN(C#C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H15NO4/c17-14-8-4-5-9-16(10-11-19-14)15(18)20-12-13-6-2-1-3-7-13/h1-3,6-7H,4,8,10-12H2