(2R,3R)-4-methyl-3-morpholin-4-ium-4-yl-2-phenyl-pentanenitrile

Systemtic Name: (2R,3R)-4-methyl-3-morpholin-4-ium-4-yl-2-phenyl-pentanenitrile Openeye Name: (2R,3R)-4-methyl-3-morpholin-4-ium-4-yl-2-phenyl-pentanenitrile CAS Name: (2R,3R)-4-methyl-3-(4-morpholin-4-iumyl)-2-phenylpentanenitrile IUPAC Name: (2R,3R)-4-methyl-3-morpholin-4-ium-4-yl-2-phenylpentanenitrile Traditional Name: (2R,3R)-4-methyl-3-morpholin-4-ium-4-yl-2-phenyl-valeronitrile Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C#N)C1=CC=CC=C1)[NH+]2CCOCC2

Isomeric SMILES

CC(C)[C@H]([C@H](C#N)C1=CC=CC=C1)[NH+]2CCOCC2

InChI

InChI=1S/C16H22N2O/c1-13(2)16(18-8-10-19-11-9-18)15(12-17)14-6-4-3-5-7-14/h3-7,13,15-16H,8-11H2,1-2H3/p+1/t15-,16-/m1/s1