N-[5-[2,3-bis(oxidanyl)propoxymethyl]-2-piperidin-1-yl-phenyl]-5-cyano-furan-2-carboxamide

Systemtic Name: N-[5-[2,3-bis(oxidanyl)propoxymethyl]-2-piperidin-1-yl-phenyl]-5-cyano-furan-2-carboxamide Openeye Name: 5-cyano-N-[5-(2,3-dihydroxypropoxymethyl)-2-(1-piperidyl)phenyl]furan-2-carboxamide CAS Name: 5-cyano-N-[5-(2,3-dihydroxypropoxymethyl)-2-(1-piperidinyl)phenyl]-2-furancarboxamide IUPAC Name: 5-cyano-N-[5-(2,3-dihydroxypropoxymethyl)-2-piperidin-1-ylphenyl]furan-2-carboxamide Traditional Name: 5-cyano-N-[5-(glyceryloxymethyl)-2-piperidino-phenyl]-2-furamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)COCC(CO)O)NC(=O)C3=CC=C(O3)C#N

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)COCC(CO)O)NC(=O)C3=CC=C(O3)C#N

InChI

InChI=1S/C21H25N3O5/c22-11-17-5-7-20(29-17)21(27)23-18-10-15(13-28-14-16(26)12-25)4-6-19(18)24-8-2-1-3-9-24/h4-7,10,16,25-26H,1-3,8-9,12-14H2,(H,23,27)