2-naphthalen-1-yl-5-(2-piperidin-1-ium-1-ylethylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-naphthalen-1-yl-5-(2-piperidin-1-ium-1-ylethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(1-naphthyl)-5-(2-piperidin-1-ium-1-ylethylamino)oxazole-4-carbonitrile CAS Name: 2-(1-naphthalenyl)-5-[2-(1-piperidin-1-iumyl)ethylamino]-4-oxazolecarbonitrile IUPAC Name: 2-naphthalen-1-yl-5-(2-piperidin-1-ium-1-ylethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(1-naphthyl)-5-(2-piperidin-1-ium-1-ylethylamino)oxazole-4-carbonitrile Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC2=C(N=C(O2)C3=CC=CC4=CC=CC=C43)C#N

Isomeric SMILES

C1CC[NH+](CC1)CCNC2=C(N=C(O2)C3=CC=CC4=CC=CC=C43)C#N

InChI

InChI=1S/C21H22N4O/c22-15-19-21(23-11-14-25-12-4-1-5-13-25)26-20(24-19)18-10-6-8-16-7-2-3-9-17(16)18/h2-3,6-10,23H,1,4-5,11-14H2/p+1