(5-oxidanylidene-1-prop-1-ynyl-pyrrolidin-3-yl) benzoate

Systemtic Name: (5-oxidanylidene-1-prop-1-ynyl-pyrrolidin-3-yl) benzoate Openeye Name: (5-oxo-1-prop-1-ynyl-pyrrolidin-3-yl) benzoate CAS Name: benzoic acid (5-oxo-1-prop-1-ynyl-3-pyrrolidinyl) ester IUPAC Name: (5-oxo-1-prop-1-ynylpyrrolidin-3-yl) benzoate Traditional Name: benzoic acid (5-keto-1-prop-1-ynyl-pyrrolidin-3-yl) ester Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

CC#CN1CC(CC1=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC#CN1CC(CC1=O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H13NO3/c1-2-8-15-10-12(9-13(15)16)18-14(17)11-6-4-3-5-7-11/h3-7,12H,9-10H2,1H3