2-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-6-chloranyl-1,3-bis(oxidanylidene)isoindole-5-sulfonamide

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-6-chloranyl-1,3-bis(oxidanylidene)isoindole-5-sulfonamide Openeye Name: 2-[1-[(4-bromophenyl)methyl]-4-piperidyl]-6-chloro-1,3-dioxo-isoindoline-5-sulfonamide CAS Name: 2-[1-[(4-bromophenyl)methyl]-4-piperidinyl]-6-chloro-1,3-dioxo-5-isoindolesulfonamide IUPAC Name: 2-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-6-chloro-1,3-dioxoisoindole-5-sulfonamide Traditional Name: 2-[1-(4-bromobenzyl)-4-piperidyl]-6-chloro-1,3-diketo-isoindoline-5-sulfonamide Formula: C20H19BrClN3O4S MolecularWeight: 512.80456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)C3=CC(=C(C=C3C2=O)Cl)S(=O)(=O)N)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1N2C(=O)C3=CC(=C(C=C3C2=O)Cl)S(=O)(=O)N)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrClN3O4S/c21-13-3-1-12(2-4-13)11-24-7-5-14(6-8-24)25-19(26)15-9-17(22)18(30(23,28)29)10-16(15)20(25)27/h1-4,9-10,14H,5-8,11H2,(H2,23,28,29)