4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C23H22F2N4O5 MolecularWeight: 472.441386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C23H22F2N4O5/c1-33-20-11-15(19(29(31)32)12-21(20)34-23(24)25)22(30)27-17-5-6-18(28-9-3-2-4-10-28)14-7-8-26-13-16(14)17/h5-8,11-13,23H,2-4,9-10H2,1H3,(H,27,30)