dimethyl 2-[3-aminocarbonyl-1-(phenylmethyl)pyridin-4-ylidene]propanedioate

Systemtic Name: dimethyl 2-[3-aminocarbonyl-1-(phenylmethyl)pyridin-4-ylidene]propanedioate Openeye Name: dimethyl 2-(1-benzyl-3-carbamoyl-4-pyridylidene)propanedioate CAS Name: 2-[3-carbamoyl-1-(phenylmethyl)-4-pyridinylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(1-benzyl-3-carbamoylpyridin-4-ylidene)propanedioate Traditional Name: 2-(1-benzyl-3-carbamoyl-4-pyridylidene)malonic acid dimethyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1C=CN(C=C1C(=O)N)CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C(=C1C=CN(C=C1C(=O)N)CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O5/c1-24-17(22)15(18(23)25-2)13-8-9-20(11-14(13)16(19)21)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H2,19,21)