3-nitro-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-(4-hydroxy-1-piperidyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-(4-hydroxy-1-piperidinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-(4-hydroxypiperidin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-(4-hydroxypiperidino)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCC(CC4)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCC(CC4)O)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c27-19-9-13-24(14-10-19)18-6-4-17(5-7-18)23-22(28)16-3-8-20(21(15-16)26(29)30)25-11-1-2-12-25/h3-8,15,19,27H,1-2,9-14H2,(H,23,28)