2-iodanyl-1-(phenylsulfonyl)-4-piperazin-1-yl-indole hydrochloride

Systemtic Name: 2-iodanyl-1-(phenylsulfonyl)-4-piperazin-1-yl-indole hydrochloride Openeye Name: 1-(benzenesulfonyl)-2-iodo-4-piperazin-1-yl-indole hydrochloride CAS Name: 1-(benzenesulfonyl)-2-iodo-4-(1-piperazinyl)indole hydrochloride IUPAC Name: 1-(benzenesulfonyl)-2-iodo-4-piperazin-1-ylindole hydrochloride Traditional Name: 1-besyl-2-iodo-4-piperazino-indole hydrochloride Formula: C18H19ClIN3O2S MolecularWeight: 503.78483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2C=C(N3S(=O)(=O)C4=CC=CC=C4)I.Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2C=C(N3S(=O)(=O)C4=CC=CC=C4)I.Cl

InChI

InChI=1S/C18H18IN3O2S.ClH/c19-18-13-15-16(21-11-9-20-10-12-21)7-4-8-17(15)22(18)25(23,24)14-5-2-1-3-6-14;/h1-8,13,20H,9-12H2;1H