2-[1-oxidanylidene-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]ethanoic acid

Systemtic Name: 2-[1-oxidanylidene-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]ethanoic acid Openeye Name: 2-[1-oxo-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]acetic acid CAS Name: 2-[1-oxo-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]acetic acid IUPAC Name: 2-[1-oxo-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]acetic acid Traditional Name: 2-[1-keto-7-(2-phenylethynyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]acetic acid Formula: C17H14N2O3 MolecularWeight: 294.30466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N2C=C(C=C2C(=O)N1)C#CC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1C(N2C=C(C=C2C(=O)N1)C#CC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C17H14N2O3/c20-16(21)9-14-10-18-17(22)15-8-13(11-19(14)15)7-6-12-4-2-1-3-5-12/h1-5,8,11,14H,9-10H2,(H,18,22)(H,20,21)