3-[(1-oxidanylidene-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-[(1-oxidanylidene-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-[(1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-[(1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-[(1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-[(1-keto-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-phenyl-cinchoninic acid Formula: C24H19N3O3 MolecularWeight: 397.42596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=CC=CN21)CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CN(C(=O)C2=CC=CN21)CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C24H19N3O3/c28-23-20-11-6-12-26(20)13-14-27(23)15-18-21(24(29)30)17-9-4-5-10-19(17)25-22(18)16-7-2-1-3-8-16/h1-12H,13-15H2,(H,29,30)