3-[(2,4-dichlorophenyl)methyl]-2H-isoindole-1-carboxylic acid

Systemtic Name: 3-[(2,4-dichlorophenyl)methyl]-2H-isoindole-1-carboxylic acid Openeye Name: 3-[(2,4-dichlorophenyl)methyl]-2H-isoindole-1-carboxylic acid CAS Name: 3-[(2,4-dichlorophenyl)methyl]-2H-isoindole-1-carboxylic acid IUPAC Name: 3-[(2,4-dichlorophenyl)methyl]-2H-isoindole-1-carboxylic acid Traditional Name: 3-(2,4-dichlorobenzyl)-2H-isoindole-1-carboxylic acid Formula: C16H11Cl2NO2 MolecularWeight: 320.17004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NC(=C2C=C1)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC2=C(NC(=C2C=C1)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H11Cl2NO2/c17-10-6-5-9(13(18)8-10)7-14-11-3-1-2-4-12(11)15(19-14)16(20)21/h1-6,8,19H,7H2,(H,20,21)