[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-oxidanylbenzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-oxidanylbenzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)NCCC#N)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)NCCC#N)O

InChI

InChI=1S/C12H12N2O4/c13-6-1-7-14-11(16)8-18-12(17)9-2-4-10(15)5-3-9/h2-5,15H,1,7-8H2,(H,14,16)