4-[2-(4-chlorophenyl)-2-(phenylmethyl)piperazin-1-yl]-1-ethoxy-indole-2,3-dione

Systemtic Name: 4-[2-(4-chlorophenyl)-2-(phenylmethyl)piperazin-1-yl]-1-ethoxy-indole-2,3-dione Openeye Name: 4-[2-benzyl-2-(4-chlorophenyl)piperazin-1-yl]-1-ethoxy-indoline-2,3-dione CAS Name: 4-[2-(4-chlorophenyl)-2-(phenylmethyl)-1-piperazinyl]-1-ethoxyindole-2,3-dione IUPAC Name: 4-[2-benzyl-2-(4-chlorophenyl)piperazin-1-yl]-1-ethoxyindole-2,3-dione Traditional Name: 4-[2-benzyl-2-(4-chlorophenyl)piperazino]-1-ethoxy-isatin Formula: C27H26ClN3O3 MolecularWeight: 475.96664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON1C2=C(C(=CC=C2)N3CCNCC3(CC4=CC=CC=C4)C5=CC=C(C=C5)Cl)C(=O)C1=O

Isomeric SMILES

CCON1C2=C(C(=CC=C2)N3CCNCC3(CC4=CC=CC=C4)C5=CC=C(C=C5)Cl)C(=O)C1=O

InChI

InChI=1S/C27H26ClN3O3/c1-2-34-31-23-10-6-9-22(24(23)25(32)26(31)33)30-16-15-29-18-27(30,17-19-7-4-3-5-8-19)20-11-13-21(28)14-12-20/h3-14,29H,2,15-18H2,1H3