2-[(2-fluoranylphenoxy)methyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(2-fluoranylphenoxy)methyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(2-fluorophenoxy)methyl]-5-(3-morpholin-4-ium-4-ylpropylamino)oxazole-4-carbonitrile CAS Name: 2-[(2-fluorophenoxy)methyl]-5-[3-(4-morpholin-4-iumyl)propylamino]-4-oxazolecarbonitrile IUPAC Name: 2-[(2-fluorophenoxy)methyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(2-fluorophenoxy)methyl]-5-(3-morpholin-4-ium-4-ylpropylamino)oxazole-4-carbonitrile Formula: C18H22FN4O3+ MolecularWeight: 361.390683

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(N=C(O2)COC3=CC=CC=C3F)C#N

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(N=C(O2)COC3=CC=CC=C3F)C#N

InChI

InChI=1S/C18H21FN4O3/c19-14-4-1-2-5-16(14)25-13-17-22-15(12-20)18(26-17)21-6-3-7-23-8-10-24-11-9-23/h1-2,4-5,21H,3,6-11,13H2/p+1