4-[2-[4-[(E,1R)-3-phenyl-1-thiophen-2-yl-pent-2-enyl]phenoxy]ethyl]morpholin-4-ium

Systemtic Name: 4-[2-[4-[(E,1R)-3-phenyl-1-thiophen-2-yl-pent-2-enyl]phenoxy]ethyl]morpholin-4-ium Openeye Name: 4-[2-[4-[(E,1R)-3-phenyl-1-(2-thienyl)pent-2-enyl]phenoxy]ethyl]morpholin-4-ium CAS Name: 4-[2-[4-[(E,1R)-3-phenyl-1-thiophen-2-ylpent-2-enyl]phenoxy]ethyl]morpholin-4-ium IUPAC Name: 4-[2-[4-[(E,1R)-3-phenyl-1-thiophen-2-ylpent-2-enyl]phenoxy]ethyl]morpholin-4-ium Traditional Name: 4-[2-[4-[(E,1R)-3-phenyl-1-(2-thienyl)pent-2-enyl]phenoxy]ethyl]morpholin-4-ium Formula: C27H32NO2S+ MolecularWeight: 434.61348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(C1=CC=C(C=C1)OCC[NH+]2CCOCC2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC/C(=C\[C@H](C1=CC=C(C=C1)OCC[NH+]2CCOCC2)C3=CC=CS3)/C4=CC=CC=C4

InChI

InChI=1S/C27H31NO2S/c1-2-22(23-7-4-3-5-8-23)21-26(27-9-6-20-31-27)24-10-12-25(13-11-24)30-19-16-28-14-17-29-18-15-28/h3-13,20-21,26H,2,14-19H2,1H3/p+1/b22-21+/t26-/m1/s1