1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]azetidine; (E)-but-2-enedioic acid

Systemtic Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]azetidine; (E)-but-2-enedioic acid Openeye Name: 1-[3-[2-(benzothiophen-5-yl)ethoxy]propyl]azetidine; fumaric acid CAS Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]azetidine; (E)-2-butenedioic acid IUPAC Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]azetidine; (E)-but-2-enedioic acid Traditional Name: 1-[3-[2-(benzothiophen-5-yl)ethoxy]propyl]azetidine; fumaric acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)CCCOCCC2=CC3=C(C=C2)SC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(C1)CCCOCCC2=CC3=C(C=C2)SC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H21NOS.C4H4O4/c1-7-17(8-1)9-2-10-18-11-5-14-3-4-16-15(13-14)6-12-19-16;5-3(6)1-2-4(7)8/h3-4,6,12-13H,1-2,5,7-11H2;1-2H,(H,5,6)(H,7,8)/b;2-1+