6-chloranyl-4-phenyl-4-(phenylmethyl)-1,3-benzodioxine-2-carboxylic acid

Systemtic Name: 6-chloranyl-4-phenyl-4-(phenylmethyl)-1,3-benzodioxine-2-carboxylic acid Openeye Name: 4-benzyl-6-chloro-4-phenyl-1,3-benzodioxine-2-carboxylic acid CAS Name: 6-chloro-4-phenyl-4-(phenylmethyl)-1,3-benzodioxin-2-carboxylic acid IUPAC Name: 4-benzyl-6-chloro-4-phenyl-1,3-benzodioxine-2-carboxylic acid Traditional Name: 4-benzyl-6-chloro-4-phenyl-1,3-benzodioxin-2-carboxylic acid Formula: C22H17ClO4 MolecularWeight: 380.82098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C3=C(C=CC(=C3)Cl)OC(O2)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2(C3=C(C=CC(=C3)Cl)OC(O2)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H17ClO4/c23-17-11-12-19-18(13-17)22(16-9-5-2-6-10-16,27-21(26-19)20(24)25)14-15-7-3-1-4-8-15/h1-13,21H,14H2,(H,24,25)