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

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(cyclohexylcarbonylamino)ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(cyclohexanecarbonylamino)acetate CAS Name: 2-[[cyclohexyl(oxo)methyl]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-(cyclohexanecarbonylamino)acetate Traditional Name: 2-(cyclohexanecarbonylamino)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H22ClNO5 MolecularWeight: 367.82398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

C1CCC(CC1)C(=O)NCC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C18H22ClNO5/c19-15-6-13-9-23-11-25-17(13)14(7-15)10-24-16(21)8-20-18(22)12-4-2-1-3-5-12/h6-7,12H,1-5,8-11H2,(H,20,22)