(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetate CAS Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetate Traditional Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H18ClNO7 MolecularWeight: 443.83382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C22H18ClNO7/c1-12(25)24-15-2-3-16-14(9-21(27)31-18(16)10-15)11-30-20(26)8-13-6-17(23)22-19(7-13)28-4-5-29-22/h2-3,6-7,9-10H,4-5,8,11H2,1H3,(H,24,25)