4-azanyl-2-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyl-isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyl-isoindole-1,3-dione Openeye Name: 4-amino-2-[4-chloro-3-(1-piperidylsulfonyl)benzoyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)isoindole-1,3-dione Traditional Name: 4-amino-2-(4-chloro-3-piperidinosulfonyl-benzoyl)isoindoline-1,3-quinone Formula: C20H18ClN3O5S MolecularWeight: 447.89202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)Cl

InChI

InChI=1S/C20H18ClN3O5S/c21-14-8-7-12(11-16(14)30(28,29)23-9-2-1-3-10-23)18(25)24-19(26)13-5-4-6-15(22)17(13)20(24)27/h4-8,11H,1-3,9-10,22H2