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3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one

Systemtic Name:	3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one
Openeye Name:	3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one
CAS Name:	3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one
IUPAC Name:	3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one
Traditional Name:	3-(2,2-dihexoxyethyl)-6H-benzo[c][1]benzothiepin-11-one
Formula:	C₂₈H₃₈O₃S
MolecularWeight:	454.66452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2)OCCCCCC

Isomeric SMILES

CCCCCCOC(CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2)OCCCCCC

InChI

InChI=1S/C28H38O3S/c1-3-5-7-11-17-30-27(31-18-12-8-6-4-2)20-22-15-16-25-26(19-22)32-21-23-13-9-10-14-24(23)28(25)29/h9-10,13-16,19,27H,3-8,11-12,17-18,20-21H2,1-2H3

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