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

Systemtic Name: 2-(2-azanylethyl)-5-chloranyl-3-phenyl-isoindole-1-carboxylic acid Openeye Name: 2-(2-aminoethyl)-5-chloro-3-phenyl-isoindole-1-carboxylic acid CAS Name: 2-(2-aminoethyl)-5-chloro-3-phenyl-1-isoindolecarboxylic acid IUPAC Name: 2-(2-aminoethyl)-5-chloro-3-phenylisoindole-1-carboxylic acid Traditional Name: 2-(2-aminoethyl)-5-chloro-3-phenyl-isoindole-1-carboxylic acid Formula: C17H15ClN2O2 MolecularWeight: 314.7662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=C(N2CCN)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=C(N2CCN)C(=O)O)Cl

InChI

InChI=1S/C17H15ClN2O2/c18-12-6-7-13-14(10-12)15(11-4-2-1-3-5-11)20(9-8-19)16(13)17(21)22/h1-7,10H,8-9,19H2,(H,21,22)