2-(4-chlorophenyl)-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(4-chlorophenyl)-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-chlorophenyl)-5-(3-morpholin-4-ium-4-ylpropylamino)oxazole-4-carbonitrile CAS Name: 2-(4-chlorophenyl)-5-[3-(4-morpholin-4-iumyl)propylamino]-4-oxazolecarbonitrile IUPAC Name: 2-(4-chlorophenyl)-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-chlorophenyl)-5-(3-morpholin-4-ium-4-ylpropylamino)oxazole-4-carbonitrile Formula: C17H20ClN4O2+ MolecularWeight: 347.8193

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C17H19ClN4O2/c18-14-4-2-13(3-5-14)16-21-15(12-19)17(24-16)20-6-1-7-22-8-10-23-11-9-22/h2-5,20H,1,6-11H2/p+1