4-(9-chloranyl-1-oxidanylidene-2H-benzo[h]isoquinolin-4-yl)benzoic acid

Systemtic Name: 4-(9-chloranyl-1-oxidanylidene-2H-benzo[h]isoquinolin-4-yl)benzoic acid Openeye Name: 4-(9-chloro-1-oxo-2H-benzo[h]isoquinolin-4-yl)benzoic acid CAS Name: 4-(9-chloro-1-oxo-2H-benzo[h]isoquinolin-4-yl)benzoic acid IUPAC Name: 4-(9-chloro-1-oxo-2H-benzo[h]isoquinolin-4-yl)benzoic acid Traditional Name: 4-(9-chloro-1-keto-2H-benz[h]isoquinolin-4-yl)benzoic acid Formula: C20H12ClNO3 MolecularWeight: 349.76718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC3=C2C(=O)NC=C3C4=CC=C(C=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC2=C1C=CC3=C2C(=O)NC=C3C4=CC=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C20H12ClNO3/c21-14-7-5-11-6-8-15-17(10-22-19(23)18(15)16(11)9-14)12-1-3-13(4-2-12)20(24)25/h1-10H,(H,22,23)(H,24,25)