N-[4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-[(2,5-dioxo-1-pyrrolidinyl)methyl]phenyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: 1-esyl-N-[4-(succinimidomethyl)phenyl]isonipecotamide Formula: C19H25N3O5S MolecularWeight: 407.4839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)CN3C(=O)CCC3=O

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)CN3C(=O)CCC3=O

InChI

InChI=1S/C19H25N3O5S/c1-2-28(26,27)21-11-9-15(10-12-21)19(25)20-16-5-3-14(4-6-16)13-22-17(23)7-8-18(22)24/h3-6,15H,2,7-13H2,1H3,(H,20,25)