(2E,6S)-2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylidene]-6-methyl-cyclohexan-1-one

Systemtic Name: (2E,6S)-2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylidene]-6-methyl-cyclohexan-1-one Openeye Name: (2E,6S)-2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylene]-6-methyl-cyclohexanone CAS Name: (2E,6S)-2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylidene]-6-methyl-1-cyclohexanone IUPAC Name: (2E,6S)-2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylidene]-6-methylcyclohexan-1-one Traditional Name: (2E,6S)-2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylene]-6-methyl-cyclohexanone Formula: C17H19ClO3 MolecularWeight: 306.78396

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=CC2=CC3=C(C(=C2)Cl)OCCCO3)C1=O

Isomeric SMILES

C[C@H]1CCC/C(=C\C2=CC3=C(C(=C2)Cl)OCCCO3)/C1=O

InChI

InChI=1S/C17H19ClO3/c1-11-4-2-5-13(16(11)19)8-12-9-14(18)17-15(10-12)20-6-3-7-21-17/h8-11H,2-7H2,1H3/b13-8+/t11-/m0/s1