[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 9H-xanthene-9-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 9H-xanthene-9-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C19H16N2O4/c20-10-5-11-21-17(22)12-24-19(23)18-13-6-1-3-8-15(13)25-16-9-4-2-7-14(16)18/h1-4,6-9,18H,5,11-12H2,(H,21,22)