2-[2-(1,3-benzothiazol-2-yl)ethyl]indene-1,3-dione

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)ethyl]indene-1,3-dione Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)ethyl]indane-1,3-dione CAS Name: 2-[2-(1,3-benzothiazol-2-yl)ethyl]indene-1,3-dione IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)ethyl]indene-1,3-dione Traditional Name: 2-[2-(1,3-benzothiazol-2-yl)ethyl]indane-1,3-quinone Formula: C18H13NO2S MolecularWeight: 307.36632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H13NO2S/c20-17-11-5-1-2-6-12(11)18(21)13(17)9-10-16-19-14-7-3-4-8-15(14)22-16/h1-8,13H,9-10H2