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

Systemtic Name: 2-(4-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile CAS Name: 2-(4-chlorophenyl)-5-[2-(4-morpholin-4-iumyl)ethylamino]-4-oxazolecarbonitrile IUPAC Name: 2-(4-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile Formula: C16H18ClN4O2+ MolecularWeight: 333.79272

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1COCC[NH+]1CCNC2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H17ClN4O2/c17-13-3-1-12(2-4-13)15-20-14(11-18)16(23-15)19-5-6-21-7-9-22-10-8-21/h1-4,19H,5-10H2/p+1