1-[2-[2-(1-benzothiophen-5-yl)ethoxy]ethyl]pyrrolidin-3-ol; ethanedioic acid

Systemtic Name: 1-[2-[2-(1-benzothiophen-5-yl)ethoxy]ethyl]pyrrolidin-3-ol; ethanedioic acid Openeye Name: 1-[2-[2-(benzothiophen-5-yl)ethoxy]ethyl]pyrrolidin-3-ol; oxalic acid CAS Name: 1-[2-[2-(1-benzothiophen-5-yl)ethoxy]ethyl]-3-pyrrolidinol; oxalic acid IUPAC Name: 1-[2-[2-(1-benzothiophen-5-yl)ethoxy]ethyl]pyrrolidin-3-ol; oxalic acid Traditional Name: 1-[2-[2-(benzothiophen-5-yl)ethoxy]ethyl]pyrrolidin-3-ol; oxalic acid Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CCOCCC2=CC3=C(C=C2)SC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CC1O)CCOCCC2=CC3=C(C=C2)SC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H21NO2S.C2H2O4/c18-15-3-6-17(12-15)7-9-19-8-4-13-1-2-16-14(11-13)5-10-20-16;3-1(4)2(5)6/h1-2,5,10-11,15,18H,3-4,6-9,12H2;(H,3,4)(H,5,6)