ethyl 4-(8-chloranyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(8-chloranyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)-4-oxo-butanoate CAS Name: 4-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)-4-oxobutanoate Traditional Name: 4-(8-chloro-11-keto-6H-benzo[c][1]benzothiepin-3-yl)-4-keto-butyric acid ethyl ester Formula: C20H17ClO4S MolecularWeight: 388.86458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC2=C(C=C1)C(=O)C3=C(CS2)C=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC2=C(C=C1)C(=O)C3=C(CS2)C=C(C=C3)Cl

InChI

InChI=1S/C20H17ClO4S/c1-2-25-19(23)8-7-17(22)12-3-5-16-18(10-12)26-11-13-9-14(21)4-6-15(13)20(16)24/h3-6,9-10H,2,7-8,11H2,1H3