[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

C#CCNC(=O)COC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H14N2O5/c1-2-7-17-13(19)10-23-15(21)9-18-14(20)8-11-5-3-4-6-12(11)16(18)22/h1,3-6H,7-10H2,(H,17,19)