(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[(3-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[(3-methoxyphenyl)carbonylamino]ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[(3-methoxybenzoyl)amino]acetate CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[(3-methoxybenzoyl)amino]acetate Traditional Name: 2-(m-anisoylamino)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C19H18ClNO6 MolecularWeight: 391.80232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C19H18ClNO6/c1-24-16-4-2-3-12(7-16)19(23)21-8-17(22)26-10-14-6-15(20)5-13-9-25-11-27-18(13)14/h2-7H,8-11H2,1H3,(H,21,23)