4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(pyrrolidin-3-ylmethyl)piperazin-2-one hydrochloride

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(pyrrolidin-3-ylmethyl)piperazin-2-one hydrochloride Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-(pyrrolidin-3-ylmethyl)piperazin-2-one hydrochloride CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-(3-pyrrolidinylmethyl)-2-piperazinone hydrochloride IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-1-(pyrrolidin-3-ylmethyl)piperazin-2-one hydrochloride Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-(pyrrolidin-3-ylmethyl)piperazin-2-one hydrochloride Formula: C19H23Cl2N3O3S MolecularWeight: 444.37522

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

Isomeric SMILES

C1CNCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

InChI

InChI=1S/C19H22ClN3O3S.ClH/c20-17-3-1-16-10-18(4-2-15(16)9-17)27(25,26)23-8-7-22(19(24)13-23)12-14-5-6-21-11-14;/h1-4,9-10,14,21H,5-8,11-13H2;1H