2-[4-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone hydrochloride

Systemtic Name: 2-[4-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone hydrochloride Openeye Name: 2-[4-(4-chloro-3-morpholinosulfonyl-benzoyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone hydrochloride CAS Name: 2-[4-[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone hydrochloride IUPAC Name: 2-[4-(4-chloro-3-morpholin-4-ylsulfonylbenzoyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone hydrochloride Traditional Name: 2-[4-(4-chloro-3-morpholinosulfonyl-benzoyl)piperazino]-1-pyrrolidino-ethanone hydrochloride Formula: C21H30Cl2N4O5S MolecularWeight: 521.4577

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4.Cl

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4.Cl

InChI

InChI=1S/C21H29ClN4O5S.ClH/c22-18-4-3-17(15-19(18)32(29,30)26-11-13-31-14-12-26)21(28)25-9-7-23(8-10-25)16-20(27)24-5-1-2-6-24;/h3-4,15H,1-2,5-14,16H2;1H