[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate CAS Name: 4-cyano-2-methyl-5-(1-pyrrolyl)-3-furancarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carboxylate Traditional Name: 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C

InChI

InChI=1S/C18H21N3O4/c1-4-7-12(2)20-15(22)11-24-18(23)16-13(3)25-17(14(16)10-19)21-8-5-6-9-21/h5-6,8-9,12H,4,7,11H2,1-3H3,(H,20,22)