ethyl 3-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]propanoate

Systemtic Name: ethyl 3-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]propanoate Openeye Name: ethyl 3-[4-[[(E)-10-(2-thienyl)dec-9-enyl]amino]phenyl]propanoate CAS Name: 3-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]propanoate Traditional Name: 3-[4-[[(E)-10-(2-thienyl)dec-9-enyl]amino]phenyl]propionic acid ethyl ester Formula: C25H35NO2S MolecularWeight: 413.6159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(C=C1)NCCCCCCCCC=CC2=CC=CS2

Isomeric SMILES

CCOC(=O)CCC1=CC=C(C=C1)NCCCCCCCC/C=C/C2=CC=CS2

InChI

InChI=1S/C25H35NO2S/c1-2-28-25(27)19-16-22-14-17-23(18-15-22)26-20-10-8-6-4-3-5-7-9-12-24-13-11-21-29-24/h9,11-15,17-18,21,26H,2-8,10,16,19-20H2,1H3/b12-9+