methyl 2-[2-methyl-1-(pent-4-ynoylamino)propyl]-5-(3-oxidanylidene-3-prop-2-enoxy-propyl)-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[2-methyl-1-(pent-4-ynoylamino)propyl]-5-(3-oxidanylidene-3-prop-2-enoxy-propyl)-1,3-oxazole-4-carboxylate Openeye Name: methyl 5-(3-allyloxy-3-oxo-propyl)-2-[2-methyl-1-(pent-4-ynoylamino)propyl]oxazole-4-carboxylate CAS Name: 2-[2-methyl-1-(1-oxopent-4-ynylamino)propyl]-5-(3-oxo-3-prop-2-enoxypropyl)-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-methyl-1-(pent-4-ynoylamino)propyl]-5-(3-oxo-3-prop-2-enoxypropyl)-1,3-oxazole-4-carboxylate Traditional Name: 5-(3-allyloxy-3-keto-propyl)-2-[2-methyl-1-(pent-4-ynoylamino)propyl]oxazole-4-carboxylic acid methyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC(=C(O1)CCC(=O)OCC=C)C(=O)OC)NC(=O)CCC#C

Isomeric SMILES

CC(C)C(C1=NC(=C(O1)CCC(=O)OCC=C)C(=O)OC)NC(=O)CCC#C

InChI

InChI=1S/C20H26N2O6/c1-6-8-9-15(23)21-17(13(3)4)19-22-18(20(25)26-5)14(28-19)10-11-16(24)27-12-7-2/h1,7,13,17H,2,8-12H2,3-5H3,(H,21,23)