2-(4-morpholin-4-ylsulfonylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone hydrochloride

Systemtic Name: 2-(4-morpholin-4-ylsulfonylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone hydrochloride Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(4-morpholinosulfonylphenoxy)ethanone hydrochloride CAS Name: 2-[4-(4-morpholinylsulfonyl)phenoxy]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone hydrochloride IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone hydrochloride Traditional Name: 1-(4-benzylpiperazino)-2-(4-morpholinosulfonylphenoxy)ethanone hydrochloride Formula: C23H30ClN3O5S MolecularWeight: 496.0194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4.Cl

InChI

InChI=1S/C23H29N3O5S.ClH/c27-23(25-12-10-24(11-13-25)18-20-4-2-1-3-5-20)19-31-21-6-8-22(9-7-21)32(28,29)26-14-16-30-17-15-26;/h1-9H,10-19H2;1H