(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-methoxy-4-propoxy-benzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-methoxy-4-propoxy-benzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-methoxy-4-propoxy-benzoate CAS Name: 3-methoxy-4-propoxybenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-methoxy-4-propoxybenzoate Traditional Name: 3-methoxy-4-propoxy-benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H21ClO6 MolecularWeight: 392.83014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)OC

InChI

InChI=1S/C20H21ClO6/c1-3-6-25-17-5-4-13(9-18(17)23-2)20(22)26-11-15-8-16(21)7-14-10-24-12-27-19(14)15/h4-5,7-9H,3,6,10-12H2,1-2H3