dimethyl 5-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C1=O)CO

InChI

InChI=1S/C18H18N2O6/c1-10-16(22)15(13(9-21)7-19-10)8-20-14-5-11(17(23)25-2)4-12(6-14)18(24)26-3/h4-8,20-21H,9H2,1-3H3