(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-cyanobenzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-cyanobenzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C17H12ClNO4 MolecularWeight: 329.73448

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C17H12ClNO4/c18-15-5-13-8-21-10-23-16(13)14(6-15)9-22-17(20)12-3-1-11(7-19)2-4-12/h1-6H,8-10H2