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

Systemtic Name: 4-(10-oxidanylidene-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl butanoate Openeye Name: 4-(10-oxo-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl butanoate CAS Name: butanoic 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 butanoate Traditional Name: butyric acid 4-(10-keto-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl ester Formula: C20H22O4S MolecularWeight: 358.45128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22O4S/c1-2-5-18(21)23-10-4-3-6-14-7-8-17-16(12-14)19(22)20-15(13-24-17)9-11-25-20/h7-9,11-12H,2-6,10,13H2,1H3