(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(4-methylphenyl)ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(4-methylphenyl)ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(p-tolyl)acetate CAS Name: 2-(4-methylphenyl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(4-methylphenyl)acetate Traditional Name: 2-(p-tolyl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H17ClO4 MolecularWeight: 332.77818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C18H17ClO4/c1-12-2-4-13(5-3-12)6-17(20)22-10-15-8-16(19)7-14-9-21-11-23-18(14)15/h2-5,7-8H,6,9-11H2,1H3