7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-dione

Systemtic Name: 7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-dione Openeye Name: 7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-dione CAS Name: 7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-dione IUPAC Name: 7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-dione Traditional Name: 7a-[3-(2-methoxyphenyl)-1,2-benzothiazol-5-yl]-4,5,6,7-tetrahydro-3aH-isoindole-1,3-quinone Formula: C22H20N2O3S MolecularWeight: 392.4708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NSC3=C2C=C(C=C3)C45CCCCC4C(=O)NC5=O

Isomeric SMILES

COC1=CC=CC=C1C2=NSC3=C2C=C(C=C3)C45CCCCC4C(=O)NC5=O

InChI

InChI=1S/C22H20N2O3S/c1-27-17-8-3-2-6-14(17)19-15-12-13(9-10-18(15)28-24-19)22-11-5-4-7-16(22)20(25)23-21(22)26/h2-3,6,8-10,12,16H,4-5,7,11H2,1H3,(H,23,25,26)