2-(5-ethylsulfonyl-2-methoxy-phenyl)-5-(pyrrolidin-1-ylmethyl)-1H-pyrrole hydrochloride

Systemtic Name: 2-(5-ethylsulfonyl-2-methoxy-phenyl)-5-(pyrrolidin-1-ylmethyl)-1H-pyrrole hydrochloride Openeye Name: 2-(5-ethylsulfonyl-2-methoxy-phenyl)-5-(pyrrolidin-1-ylmethyl)-1H-pyrrole hydrochloride CAS Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-5-(1-pyrrolidinylmethyl)-1H-pyrrole hydrochloride IUPAC Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-5-(pyrrolidin-1-ylmethyl)-1H-pyrrole hydrochloride Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-5-(pyrrolidinomethyl)-1H-pyrrole hydrochloride Formula: C18H25ClN2O3S MolecularWeight: 384.9207

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CN3CCCC3.Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CN3CCCC3.Cl

InChI

InChI=1S/C18H24N2O3S.ClH/c1-3-24(21,22)15-7-9-18(23-2)16(12-15)17-8-6-14(19-17)13-20-10-4-5-11-20;/h6-9,12,19H,3-5,10-11,13H2,1-2H3;1H