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

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-6-chloranyl-3-oxidanylidene-1H-isoindole-5-sulfonamide hydrochloride Openeye Name: 2-[1-[(4-bromophenyl)methyl]-4-piperidyl]-6-chloro-3-oxo-isoindoline-5-sulfonamide hydrochloride CAS Name: 2-[1-[(4-bromophenyl)methyl]-4-piperidinyl]-6-chloro-3-oxo-1H-isoindole-5-sulfonamide hydrochloride IUPAC Name: 2-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-6-chloro-3-oxo-1H-isoindole-5-sulfonamide hydrochloride Traditional Name: 2-[1-(4-bromobenzyl)-4-piperidyl]-6-chloro-3-keto-isoindoline-5-sulfonamide hydrochloride Formula: C20H22BrCl2N3O3S MolecularWeight: 535.28198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC=C(C=C4)Br.Cl

Isomeric SMILES

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC=C(C=C4)Br.Cl

InChI

InChI=1S/C20H21BrClN3O3S.ClH/c21-15-3-1-13(2-4-15)11-24-7-5-16(6-8-24)25-12-14-9-18(22)19(29(23,27)28)10-17(14)20(25)26;/h1-4,9-10,16H,5-8,11-12H2,(H2,23,27,28);1H