N-[(2-morpholin-4-ylpyridin-4-yl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylpyridin-4-yl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[(2-morpholino-4-pyridyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[[2-(4-morpholinyl)-4-pyridinyl]methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[(2-morpholin-4-ylpyridin-4-yl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[(2-morpholino-4-pyridyl)methyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC(=NC=C2)N3CCOCC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC(=NC=C2)N3CCOCC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H27N5O4/c28-22(24-16-17-5-8-23-21(15-17)26-11-13-31-14-12-26)18-6-9-25(10-7-18)19-3-1-2-4-20(19)27(29)30/h1-5,8,15,18H,6-7,9-14,16H2,(H,24,28)