(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetate CAS Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetate Traditional Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C23H20ClNO7 MolecularWeight: 457.8604

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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)OCCCO4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C23H20ClNO7/c1-13(26)25-16-3-4-17-15(10-22(28)32-19(17)11-16)12-31-21(27)9-14-7-18(24)23-20(8-14)29-5-2-6-30-23/h3-4,7-8,10-11H,2,5-6,9,12H2,1H3,(H,25,26)