5-chloranyl-2-ethyl-3-phenyl-isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-2-ethyl-3-phenyl-isoindole-1-carboxylic acid Openeye Name: 5-chloro-2-ethyl-3-phenyl-isoindole-1-carboxylic acid CAS Name: 5-chloro-2-ethyl-3-phenyl-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-2-ethyl-3-phenylisoindole-1-carboxylic acid Traditional Name: 5-chloro-2-ethyl-3-phenyl-isoindole-1-carboxylic acid Formula: C17H14ClNO2 MolecularWeight: 299.75156

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H14ClNO2/c1-2-19-15(11-6-4-3-5-7-11)14-10-12(18)8-9-13(14)16(19)17(20)21/h3-10H,2H2,1H3,(H,20,21)