1-oxidanylidene-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid

Systemtic Name: 1-oxidanylidene-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid Openeye Name: 1-oxo-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid CAS Name: 1-oxo-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid IUPAC Name: 1-oxo-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid Traditional Name: 1-keto-4-(1H-pyrrol-2-yl)-2H-isoquinoline-3-carboxylic acid Formula: C14H10N2O3 MolecularWeight: 254.2408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(NC2=O)C(=O)O)C3=CC=CN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(NC2=O)C(=O)O)C3=CC=CN3

InChI

InChI=1S/C14H10N2O3/c17-13-9-5-2-1-4-8(9)11(10-6-3-7-15-10)12(16-13)14(18)19/h1-7,15H,(H,16,17)(H,18,19)