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

Systemtic Name: 4-(10-oxidanylidene-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl benzoate Openeye Name: 4-(10-oxo-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl benzoate CAS Name: benzoic 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 benzoate Traditional Name: benzoic acid 4-(10-keto-4H-thieno[3,2-c][1]benzoxepin-8-yl)butyl ester Formula: C23H20O4S MolecularWeight: 392.4675

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=O)C3=C(O1)C=CC(=C3)CCCCOC(=O)C4=CC=CC=C4)SC=C2

Isomeric SMILES

C1C2=C(C(=O)C3=C(O1)C=CC(=C3)CCCCOC(=O)C4=CC=CC=C4)SC=C2

InChI

InChI=1S/C23H20O4S/c24-21-19-14-16(9-10-20(19)27-15-18-11-13-28-22(18)21)6-4-5-12-26-23(25)17-7-2-1-3-8-17/h1-3,7-11,13-14H,4-6,12,15H2