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

Systemtic Name: 2-(3-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(3-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile CAS Name: 2-(3-chlorophenyl)-5-[2-(4-morpholin-4-iumyl)ethylamino]-4-oxazolecarbonitrile IUPAC Name: 2-(3-chlorophenyl)-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(3-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(=CC=C3)Cl)C#N

Isomeric SMILES

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

InChI

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