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

Systemtic Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(naphthalen-1-ylmethyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(1-naphthylmethyl)oxazole-4-carbonitrile CAS Name: 5-[3-(4-morpholin-4-iumyl)propylamino]-2-(1-naphthalenylmethyl)-4-oxazolecarbonitrile IUPAC Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(naphthalen-1-ylmethyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(1-naphthylmethyl)oxazole-4-carbonitrile Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(N=C(O2)CC3=CC=CC4=CC=CC=C43)C#N

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(N=C(O2)CC3=CC=CC4=CC=CC=C43)C#N

InChI

InChI=1S/C22H24N4O2/c23-16-20-22(24-9-4-10-26-11-13-27-14-12-26)28-21(25-20)15-18-7-3-6-17-5-1-2-8-19(17)18/h1-3,5-8,24H,4,9-15H2/p+1