(2S)-3-[(2-ethyl-6-methyl-phenyl)amino]-2-methyl-propanenitrile

Systemtic Name: (2S)-3-[(2-ethyl-6-methyl-phenyl)amino]-2-methyl-propanenitrile Openeye Name: (2S)-3-(2-ethyl-6-methyl-anilino)-2-methyl-propanenitrile CAS Name: (2S)-3-(2-ethyl-6-methylanilino)-2-methylpropanenitrile IUPAC Name: (2S)-3-(2-ethyl-6-methylanilino)-2-methylpropanenitrile Traditional Name: (2S)-3-(2-ethyl-6-methyl-anilino)-2-methyl-propionitrile Formula: C13H18N2 MolecularWeight: 202.29542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NCC(C)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC[C@H](C)C#N)C

InChI

InChI=1S/C13H18N2/c1-4-12-7-5-6-11(3)13(12)15-9-10(2)8-14/h5-7,10,15H,4,9H2,1-3H3/t10-/m1/s1