[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] anthracene-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] anthracene-9-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C20H15NO3 MolecularWeight: 317.338

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C20H15NO3/c1-2-11-21-18(22)13-24-20(23)19-16-9-5-3-7-14(16)12-15-8-4-6-10-17(15)19/h1,3-10,12H,11,13H2,(H,21,22)