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

Systemtic Name: 2-(11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)ethyl heptanoate Openeye Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethyl heptanoate CAS Name: heptanoic acid 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethyl ester IUPAC Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethyl heptanoate Traditional Name: enanthic acid 2-(11-keto-6H-benzo[c][1]benzothiepin-3-yl)ethyl ester Formula: C23H26O3S MolecularWeight: 382.51574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2

Isomeric SMILES

CCCCCCC(=O)OCCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2

InChI

InChI=1S/C23H26O3S/c1-2-3-4-5-10-22(24)26-14-13-17-11-12-20-21(15-17)27-16-18-8-6-7-9-19(18)23(20)25/h6-9,11-12,15H,2-5,10,13-14,16H2,1H3