4-(4-chlorophenyl)-1-oxidanylidene-isochromene-3-carboxylate

Systemtic Name: 4-(4-chlorophenyl)-1-oxidanylidene-isochromene-3-carboxylate Openeye Name: 4-(4-chlorophenyl)-1-oxo-isochromene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-1-oxo-2-benzopyran-3-carboxylate IUPAC Name: 4-(4-chlorophenyl)-1-oxoisochromene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-isochromene-3-carboxylate Formula: C16H8ClO4- MolecularWeight: 299.68532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(OC2=O)C(=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(OC2=O)C(=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H9ClO4/c17-10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)16(20)21-14(13)15(18)19/h1-8H,(H,18,19)/p-1