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

Systemtic Name: 6-chloranyl-2-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-3-oxidanylidene-1H-isoindole-5-sulfonamide hydrochloride Openeye Name: 6-chloro-3-oxo-2-[1-(p-tolylmethyl)-4-piperidyl]isoindoline-5-sulfonamide hydrochloride CAS Name: 6-chloro-2-[1-[(4-methylphenyl)methyl]-4-piperidinyl]-3-oxo-1H-isoindole-5-sulfonamide hydrochloride IUPAC Name: 6-chloro-2-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-3-oxo-1H-isoindole-5-sulfonamide hydrochloride Traditional Name: 6-chloro-3-keto-2-[1-(4-methylbenzyl)-4-piperidyl]isoindoline-5-sulfonamide hydrochloride Formula: C21H25Cl2N3O3S MolecularWeight: 470.4125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl.Cl

InChI

InChI=1S/C21H24ClN3O3S.ClH/c1-14-2-4-15(5-3-14)12-24-8-6-17(7-9-24)25-13-16-10-19(22)20(29(23,27)28)11-18(16)21(25)26;/h2-5,10-11,17H,6-9,12-13H2,1H3,(H2,23,27,28);1H