4-[(1S,2S)-2-(4-ethanoylphenyl)cyclopropyl]benzenecarbonitrile

Systemtic Name: 4-[(1S,2S)-2-(4-ethanoylphenyl)cyclopropyl]benzenecarbonitrile Openeye Name: 4-[(1S,2S)-2-(4-acetylphenyl)cyclopropyl]benzonitrile CAS Name: 4-[(1S,2S)-2-(4-acetylphenyl)cyclopropyl]benzonitrile IUPAC Name: 4-[(1S,2S)-2-(4-acetylphenyl)cyclopropyl]benzonitrile Traditional Name: 4-[(1S,2S)-2-(4-acetylphenyl)cyclopropyl]benzonitrile Formula: C18H15NO MolecularWeight: 261.3178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2CC2C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)[C@H]2C[C@@H]2C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15NO/c1-12(20)14-6-8-16(9-7-14)18-10-17(18)15-4-2-13(11-19)3-5-15/h2-9,17-18H,10H2,1H3/t17-,18-/m1/s1