methyl 2-[3-(3-methoxy-3-oxidanylidene-propyl)-2-oxidanylidene-1H-pyridin-4-yl]-2-phenylmethoxy-butanoate

Systemtic Name: methyl 2-[3-(3-methoxy-3-oxidanylidene-propyl)-2-oxidanylidene-1H-pyridin-4-yl]-2-phenylmethoxy-butanoate Openeye Name: methyl 2-benzyloxy-2-[3-(3-methoxy-3-oxo-propyl)-2-oxo-1H-pyridin-4-yl]butanoate CAS Name: 2-[3-(3-methoxy-3-oxopropyl)-2-oxo-1H-pyridin-4-yl]-2-phenylmethoxybutanoic acid methyl ester IUPAC Name: methyl 2-[3-(3-methoxy-3-oxopropyl)-2-oxo-1H-pyridin-4-yl]-2-phenylmethoxybutanoate Traditional Name: 2-benzoxy-2-[2-keto-3-(3-keto-3-methoxy-propyl)-1H-pyridin-4-yl]butyric acid methyl ester Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=O)NC=C1)CCC(=O)OC)(C(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C1=C(C(=O)NC=C1)CCC(=O)OC)(C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-4-21(20(25)27-3,28-14-15-8-6-5-7-9-15)17-12-13-22-19(24)16(17)10-11-18(23)26-2/h5-9,12-13H,4,10-11,14H2,1-3H3,(H,22,24)