[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H20N2O5S/c1-2-10-18-16(20)13-24-17(21)14-6-8-15(9-7-14)25(22,23)19-11-4-3-5-12-19/h1,6-9H,3-5,10-13H2,(H,18,20)