(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C22H17ClN2O5 MolecularWeight: 424.83378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3=NNC(=O)C4=CC=CC=C43)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3=NNC(=O)C4=CC=CC=C43)Cl

InChI

InChI=1S/C22H17ClN2O5/c1-2-12-7-19-16(9-17(12)23)13(8-21(27)30-19)11-29-20(26)10-18-14-5-3-4-6-15(14)22(28)25-24-18/h3-9H,2,10-11H2,1H3,(H,25,28)