5-chloranyl-2-(2-dimethylaminoethyl)-3-phenyl-isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-2-(2-dimethylaminoethyl)-3-phenyl-isoindole-1-carboxylic acid Openeye Name: 5-chloro-2-(2-dimethylaminoethyl)-3-phenyl-isoindole-1-carboxylic acid CAS Name: 5-chloro-2-(2-dimethylaminoethyl)-3-phenyl-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-2-(2-dimethylaminoethyl)-3-phenylisoindole-1-carboxylic acid Traditional Name: 5-chloro-2-(2-dimethylaminoethyl)-3-phenyl-isoindole-1-carboxylic acid Formula: C19H19ClN2O2 MolecularWeight: 342.81936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN2O2/c1-21(2)10-11-22-17(13-6-4-3-5-7-13)16-12-14(20)8-9-15(16)18(22)19(23)24/h3-9,12H,10-11H2,1-2H3,(H,23,24)