2-(4-chloranyl-3-phenylmethoxy-phenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(4-chloranyl-3-phenylmethoxy-phenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-benzyloxy-4-chloro-phenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(4-chloro-3-phenylmethoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(4-chloro-3-phenylmethoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-benzoxy-4-chloro-phenyl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C21H18ClNO3 MolecularWeight: 367.82552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C21H18ClNO3/c22-18-11-10-15(12-19(18)26-13-14-6-2-1-3-7-14)23-20(24)16-8-4-5-9-17(16)21(23)25/h1-3,6-7,10-12H,4-5,8-9,13H2