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

Systemtic Name: 2-(11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)propyl hexanoate Openeye Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-3-yl)propyl hexanoate CAS Name: hexanoic 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 hexanoate Traditional Name: hexanoic acid 2-(11-keto-6H-benzo[c][1]benzothiepin-3-yl)propyl ester Formula: C23H26O3S MolecularWeight: 382.51574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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