4-[(1S,2R)-2-cyano-1-phenylazanyl-propyl]benzenecarbonitrile

Systemtic Name: 4-[(1S,2R)-2-cyano-1-phenylazanyl-propyl]benzenecarbonitrile Openeye Name: 4-[(1S,2R)-1-anilino-2-cyano-propyl]benzonitrile CAS Name: 4-[(1S,2R)-1-anilino-2-cyanopropyl]benzonitrile IUPAC Name: 4-[(1S,2R)-1-anilino-2-cyanopropyl]benzonitrile Traditional Name: 4-[(1S,2R)-1-anilino-2-cyano-propyl]benzonitrile Formula: C17H15N3 MolecularWeight: 261.3211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C(C1=CC=C(C=C1)C#N)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C#N)[C@@H](C1=CC=C(C=C1)C#N)NC2=CC=CC=C2

InChI

InChI=1S/C17H15N3/c1-13(11-18)17(20-16-5-3-2-4-6-16)15-9-7-14(12-19)8-10-15/h2-10,13,17,20H,1H3/t13-,17-/m0/s1