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

Systemtic Name: ethyl 4-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]butanoate Openeye Name: ethyl 4-[4-[[(E)-10-(2-thienyl)dec-9-enyl]amino]phenyl]butanoate CAS Name: 4-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[[(E)-10-thiophen-2-yldec-9-enyl]amino]phenyl]butanoate Traditional Name: 4-[4-[[(E)-10-(2-thienyl)dec-9-enyl]amino]phenyl]butyric acid ethyl ester Formula: C26H37NO2S MolecularWeight: 427.64248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=CC=C(C=C1)NCCCCCCCCC=CC2=CC=CS2

Isomeric SMILES

CCOC(=O)CCCC1=CC=C(C=C1)NCCCCCCCC/C=C/C2=CC=CS2

InChI

InChI=1S/C26H37NO2S/c1-2-29-26(28)16-11-13-23-17-19-24(20-18-23)27-21-10-8-6-4-3-5-7-9-14-25-15-12-22-30-25/h9,12,14-15,17-20,22,27H,2-8,10-11,13,16,21H2,1H3/b14-9+