1-azanyl-4-isoquinolin-1-yl-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carboxylic acid

Systemtic Name: 1-azanyl-4-isoquinolin-1-yl-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carboxylic acid Openeye Name: 1-amino-4-(1-isoquinolyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylic acid CAS Name: 1-amino-4-(1-isoquinolinyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylic acid IUPAC Name: 1-amino-4-isoquinolin-1-yl-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylic acid Traditional Name: 1-amino-4-(1-isoquinolyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carboxylic acid Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=CN2N)C(=O)O)C3=NC=CC4=CC=CC=C43)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=CN2N)C(=O)O)C3=NC=CC4=CC=CC=C43)C(=O)C1

InChI

InChI=1S/C19H17N3O3/c20-22-10-13(19(24)25)16(17-14(22)6-3-7-15(17)23)18-12-5-2-1-4-11(12)8-9-21-18/h1-2,4-5,8-10,16H,3,6-7,20H2,(H,24,25)