2-(11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)propyl 2-methylpropanoate

Systemtic Name: 2-(11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)propyl 2-methylpropanoate Openeye Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)propyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)propyl ester IUPAC Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)propyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid 2-(11-keto-6H-benzo[c][1]benzothiepin-3-yl)propyl ester Formula: C21H22O3S MolecularWeight: 354.46258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2

Isomeric SMILES

CC(C)C(=O)OCC(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2

InChI

InChI=1S/C21H22O3S/c1-13(2)21(23)24-11-14(3)15-8-9-18-19(10-15)25-12-16-6-4-5-7-17(16)20(18)22/h4-10,13-14H,11-12H2,1-3H3