dimethyl 2-acetamido-2-[(3-ethoxy-4-heptyl-1,2-oxazol-5-yl)methyl]propanedioate

Systemtic Name: dimethyl 2-acetamido-2-[(3-ethoxy-4-heptyl-1,2-oxazol-5-yl)methyl]propanedioate Openeye Name: dimethyl 2-acetamido-2-[(3-ethoxy-4-heptyl-isoxazol-5-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(3-ethoxy-4-heptyl-5-isoxazolyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-acetamido-2-[(3-ethoxy-4-heptyl-1,2-oxazol-5-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(3-ethoxy-4-heptyl-isoxazol-5-yl)methyl]malonic acid dimethyl ester Formula: C20H32N2O7 MolecularWeight: 412.47728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(ON=C1OCC)CC(C(=O)OC)(C(=O)OC)NC(=O)C

Isomeric SMILES

CCCCCCCC1=C(ON=C1OCC)CC(C(=O)OC)(C(=O)OC)NC(=O)C

InChI

InChI=1S/C20H32N2O7/c1-6-8-9-10-11-12-15-16(29-22-17(15)28-7-2)13-20(18(24)26-4,19(25)27-5)21-14(3)23/h6-13H2,1-5H3,(H,21,23)