4-(1-benzothiophen-3-ylmethoxy)-2-[2,6-bis(oxidanylidene)piperidin-3-yl]isoindole-1,3-dione

Systemtic Name: 4-(1-benzothiophen-3-ylmethoxy)-2-[2,6-bis(oxidanylidene)piperidin-3-yl]isoindole-1,3-dione Openeye Name: 4-(benzothiophen-3-ylmethoxy)-2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione CAS Name: 4-(1-benzothiophen-3-ylmethoxy)-2-(2,6-dioxo-3-piperidinyl)isoindole-1,3-dione IUPAC Name: 4-(1-benzothiophen-3-ylmethoxy)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione Traditional Name: 4-(benzothiophen-3-ylmethoxy)-2-(2,6-diketo-3-piperidyl)isoindoline-1,3-quinone Formula: C22H16N2O5S MolecularWeight: 420.43784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCC4=CSC5=CC=CC=C54

Isomeric SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCC4=CSC5=CC=CC=C54

InChI

InChI=1S/C22H16N2O5S/c25-18-9-8-15(20(26)23-18)24-21(27)14-5-3-6-16(19(14)22(24)28)29-10-12-11-30-17-7-2-1-4-13(12)17/h1-7,11,15H,8-10H2,(H,23,25,26)