methyl 2,4-bis(oxidanylidene)-4-[5-(phenylmethyl)-2-pyridin-2-yloxy-phenyl]butanoate

Systemtic Name: methyl 2,4-bis(oxidanylidene)-4-[5-(phenylmethyl)-2-pyridin-2-yloxy-phenyl]butanoate Openeye Name: methyl 4-[5-benzyl-2-(2-pyridyloxy)phenyl]-2,4-dioxo-butanoate CAS Name: 2,4-dioxo-4-[5-(phenylmethyl)-2-(2-pyridinyloxy)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-(5-benzyl-2-pyridin-2-yloxyphenyl)-2,4-dioxobutanoate Traditional Name: 4-[5-benzyl-2-(2-pyridyloxy)phenyl]-2,4-diketo-butyric acid methyl ester Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)CC(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)OC3=CC=CC=N3

Isomeric SMILES

COC(=O)C(=O)CC(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)OC3=CC=CC=N3

InChI

InChI=1S/C23H19NO5/c1-28-23(27)20(26)15-19(25)18-14-17(13-16-7-3-2-4-8-16)10-11-21(18)29-22-9-5-6-12-24-22/h2-12,14H,13,15H2,1H3