5-morpholin-4-yl-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 5-morpholin-4-yl-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 5-morpholino-2-nitro-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 5-(4-morpholinyl)-2-nitro-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 5-morpholin-4-yl-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: 5-morpholino-2-nitro-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C25H27N5O4 MolecularWeight: 461.51298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=C(C=CC(=C4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=C(C=CC(=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O4/c31-25(20-16-18(4-6-24(20)30(32)33)28-12-14-34-15-13-28)27-22-5-7-23(29-10-2-1-3-11-29)19-8-9-26-17-21(19)22/h4-9,16-17H,1-3,10-15H2,(H,27,31)