2-[(4-chloranylphenoxy)methyl]-5-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-5-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(4-chlorophenoxy)methyl]-5-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]oxazole-4-carbonitrile CAS Name: 2-[(4-chlorophenoxy)methyl]-5-[[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-4-oxazolecarbonitrile IUPAC Name: 2-[(4-chlorophenoxy)methyl]-5-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]amino]-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(4-chlorophenoxy)methyl]-5-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]oxazole-4-carbonitrile Formula: C23H24ClN4O2+ MolecularWeight: 423.91526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC2=C(N=C(O2)COC3=CC=C(C=C3)Cl)C#N)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC2=C(N=C(O2)COC3=CC=C(C=C3)Cl)C#N)C4=CC=CC=C4

InChI

InChI=1S/C23H23ClN4O2/c24-18-8-10-19(11-9-18)29-16-22-27-20(14-25)23(30-22)26-15-21(28-12-4-5-13-28)17-6-2-1-3-7-17/h1-3,6-11,21,26H,4-5,12-13,15-16H2/p+1/t21-/m0/s1