4-(10-oxidanylidene-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl hexanoate

Systemtic Name: 4-(10-oxidanylidene-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl hexanoate Openeye Name: 4-(10-oxo-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl hexanoate CAS Name: hexanoic acid 4-(10-oxo-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl ester IUPAC Name: 4-(10-oxo-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl hexanoate Traditional Name: hexanoic acid 4-(10-keto-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl ester Formula: C22H26O4S MolecularWeight: 386.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCCCC1=CC2=C(C=C1)OCC3=C(C2=O)SC=C3

Isomeric SMILES

CCCCCC(=O)OCCCCC1=CC2=C(C=C1)OCC3=C(C2=O)SC=C3

InChI

InChI=1S/C22H26O4S/c1-2-3-4-8-20(23)25-12-6-5-7-16-9-10-19-18(14-16)21(24)22-17(15-26-19)11-13-27-22/h9-11,13-14H,2-8,12,15H2,1H3