(3-methylquinoxalin-2-yl)methyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 4-(3,4-dimethoxyphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethoxyphenyl)-4-oxobutanoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 4-(3,4-dimethoxyphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethoxyphenyl)-4-keto-butyric acid (3-methylquinoxalin-2-yl)methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)CCC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)CCC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H22N2O5/c1-14-18(24-17-7-5-4-6-16(17)23-14)13-29-22(26)11-9-19(25)15-8-10-20(27-2)21(12-15)28-3/h4-8,10,12H,9,11,13H2,1-3H3