methyl 1,3-bis(oxidanylidene)-2-prop-2-ynyl-4H-isoquinoline-4-carboxylate

Systemtic Name: methyl 1,3-bis(oxidanylidene)-2-prop-2-ynyl-4H-isoquinoline-4-carboxylate Openeye Name: methyl 1,3-dioxo-2-prop-2-ynyl-4H-isoquinoline-4-carboxylate CAS Name: 1,3-dioxo-2-prop-2-ynyl-4H-isoquinoline-4-carboxylic acid methyl ester IUPAC Name: methyl 1,3-dioxo-2-prop-2-ynyl-4H-isoquinoline-4-carboxylate Traditional Name: 1,3-diketo-2-propargyl-4H-isoquinoline-4-carboxylic acid methyl ester Formula: C14H11NO4 MolecularWeight: 257.24144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2=CC=CC=C2C(=O)N(C1=O)CC#C

Isomeric SMILES

COC(=O)C1C2=CC=CC=C2C(=O)N(C1=O)CC#C

InChI

InChI=1S/C14H11NO4/c1-3-8-15-12(16)10-7-5-4-6-9(10)11(13(15)17)14(18)19-2/h1,4-7,11H,8H2,2H3