2-(6-chloranyl-1-oxidanylidene-4-phenyl-isochromen-3-yl)ethanoic acid

Systemtic Name: 2-(6-chloranyl-1-oxidanylidene-4-phenyl-isochromen-3-yl)ethanoic acid Openeye Name: 2-(6-chloro-1-oxo-4-phenyl-isochromen-3-yl)acetic acid CAS Name: 2-(6-chloro-1-oxo-4-phenyl-2-benzopyran-3-yl)acetic acid IUPAC Name: 2-(6-chloro-1-oxo-4-phenylisochromen-3-yl)acetic acid Traditional Name: 2-(6-chloro-1-keto-4-phenyl-isochromen-3-yl)acetic acid Formula: C17H11ClO4 MolecularWeight: 314.71984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=O)C3=C2C=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=O)C3=C2C=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C17H11ClO4/c18-11-6-7-12-13(8-11)16(10-4-2-1-3-5-10)14(9-15(19)20)22-17(12)21/h1-8H,9H2,(H,19,20)