1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]-4-(phenylsulfonyl)piperazine hydrochloride

Systemtic Name: 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]-4-(phenylsulfonyl)piperazine hydrochloride Openeye Name: 1-(benzenesulfonyl)-4-(2-chroman-4-ylethyl)piperazine hydrochloride CAS Name: 1-(benzenesulfonyl)-4-[2-(3,4-dihydro-2H-1-benzopyran-4-yl)ethyl]piperazine hydrochloride IUPAC Name: 1-(benzenesulfonyl)-4-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]piperazine hydrochloride Traditional Name: 1-besyl-4-(2-chroman-4-ylethyl)piperazine hydrochloride Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1CCN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

C1COC2=CC=CC=C2C1CCN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H26N2O3S.ClH/c24-27(25,19-6-2-1-3-7-19)23-15-13-22(14-16-23)12-10-18-11-17-26-21-9-5-4-8-20(18)21;/h1-9,18H,10-17H2;1H