(2S,3R)-2-(phenylmethyl)-3-propan-2-yl-butanedinitrile

Systemtic Name: (2S,3R)-2-(phenylmethyl)-3-propan-2-yl-butanedinitrile Openeye Name: (2S,3R)-2-benzyl-3-isopropyl-butanedinitrile CAS Name: (2S,3R)-2-(phenylmethyl)-3-propan-2-ylbutanedinitrile IUPAC Name: (2S,3R)-2-benzyl-3-propan-2-ylbutanedinitrile Traditional Name: (2S,3R)-2-benzyl-3-isopropyl-succinonitrile Formula: C14H16N2 MolecularWeight: 212.29024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)C(CC1=CC=CC=C1)C#N

Isomeric SMILES

CC(C)[C@@H](C#N)[C@H](CC1=CC=CC=C1)C#N

InChI

InChI=1S/C14H16N2/c1-11(2)14(10-16)13(9-15)8-12-6-4-3-5-7-12/h3-7,11,13-14H,8H2,1-2H3/t13-,14-/m1/s1