N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-oxidanyl-5-oxidanylidene-pyrrol-3-yl]ethanamide

Systemtic Name: N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-oxidanyl-5-oxidanylidene-pyrrol-3-yl]ethanamide Openeye Name: N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-hydroxy-5-oxo-pyrrol-3-yl]acetamide CAS Name: N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-hydroxy-5-oxo-3-pyrrolyl]acetamide IUPAC Name: N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-hydroxy-5-oxopyrrol-3-yl]acetamide Traditional Name: N-[2-(cyanomethyl)-1-(2,5-dimethoxyphenyl)-2-hydroxy-5-keto-3-pyrrolin-3-yl]acetamide Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=O)N(C1(CC#N)O)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC(=O)NC1=CC(=O)N(C1(CC#N)O)C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C16H17N3O5/c1-10(20)18-14-9-15(21)19(16(14,22)6-7-17)12-8-11(23-2)4-5-13(12)24-3/h4-5,8-9,22H,6H2,1-3H3,(H,18,20)