(2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloranyl-3H-inden-1-one

Systemtic Name: (2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloranyl-3H-inden-1-one Openeye Name: (2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloro-indan-1-one CAS Name: (2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloro-3H-inden-1-one IUPAC Name: (2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloro-3H-inden-1-one Traditional Name: (2E)-2-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-3-chloro-indan-1-one Formula: C20H17ClOS2 MolecularWeight: 372.93138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)SC(=C3C(C4=CC=CC=C4C3=O)Cl)S2

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)S/C(=C/3\C(C4=CC=CC=C4C3=O)Cl)/S2

InChI

InChI=1S/C20H17ClOS2/c1-20(2,3)11-8-9-14-15(10-11)24-19(23-14)16-17(21)12-6-4-5-7-13(12)18(16)22/h4-10,17H,1-3H3/b19-16-