N-(4-chloranyl-1-oxidanylidene-3-phenethyloxy-isochromen-7-yl)-2,2,3,3,4,4,4-heptakis(fluoranyl)butanamide

Systemtic Name: N-(4-chloranyl-1-oxidanylidene-3-phenethyloxy-isochromen-7-yl)-2,2,3,3,4,4,4-heptakis(fluoranyl)butanamide Openeye Name: N-(4-chloro-1-oxo-3-phenethyloxy-isochromen-7-yl)-2,2,3,3,4,4,4-heptafluoro-butanamide CAS Name: N-(4-chloro-1-oxo-3-phenethyloxy-2-benzopyran-7-yl)-2,2,3,3,4,4,4-heptafluorobutanamide IUPAC Name: N-(4-chloro-1-oxo-3-phenethyloxyisochromen-7-yl)-2,2,3,3,4,4,4-heptafluorobutanamide Traditional Name: N-(4-chloro-1-keto-3-phenethyloxy-isochromen-7-yl)-2,2,3,3,4,4,4-heptafluoro-butyramide Formula: C21H13ClF7NO4 MolecularWeight: 511.774042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C3=C(C=C(C=C3)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)O2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C3=C(C=C(C=C3)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)O2)Cl

InChI

InChI=1S/C21H13ClF7NO4/c22-15-13-7-6-12(30-18(32)19(23,24)20(25,26)21(27,28)29)10-14(13)16(31)34-17(15)33-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,30,32)