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

Systemtic Name: 5-(2-morpholin-4-ium-4-ylethylamino)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-benzyloxyphenyl)-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile CAS Name: 5-[2-(4-morpholin-4-iumyl)ethylamino]-2-(4-phenylmethoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(2-morpholin-4-ium-4-ylethylamino)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-benzoxyphenyl)-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile Formula: C23H25N4O3+ MolecularWeight: 405.4696

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=C(N=C(O2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N

Isomeric SMILES

C1COCC[NH+]1CCNC2=C(N=C(O2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H24N4O3/c24-16-21-23(25-10-11-27-12-14-28-15-13-27)30-22(26-21)19-6-8-20(9-7-19)29-17-18-4-2-1-3-5-18/h1-9,25H,10-15,17H2/p+1