2,4-bis(fluoranyl)-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide

Systemtic Name: 2,4-bis(fluoranyl)-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Openeye Name: 2,4-difluoro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide CAS Name: 2,4-difluoro-N-[2-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]phenyl]benzamide IUPAC Name: 2,4-difluoro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Traditional Name: 2,4-difluoro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Formula: C21H24F2N3O3+ MolecularWeight: 404.430366

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C21H23F2N3O3/c22-15-6-7-16(18(23)14-15)21(28)25-19-5-2-1-4-17(19)20(27)24-8-3-9-26-10-12-29-13-11-26/h1-2,4-7,14H,3,8-13H2,(H,24,27)(H,25,28)/p+1