4-[(2S,4R,6R)-4-chloranyl-6-phenyl-oxan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(2S,4R,6R)-4-chloranyl-6-phenyl-oxan-2-yl]benzenecarbonitrile Openeye Name: 4-[(2S,4R,6R)-4-chloro-6-phenyl-tetrahydropyran-2-yl]benzonitrile CAS Name: 4-[(2S,4R,6R)-4-chloro-6-phenyl-2-oxanyl]benzonitrile IUPAC Name: 4-[(2S,4R,6R)-4-chloro-6-phenyloxan-2-yl]benzonitrile Traditional Name: 4-[(2S,4R,6R)-4-chloro-6-phenyl-tetrahydropyran-2-yl]benzonitrile Formula: C18H16ClNO MolecularWeight: 297.77874

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(OC1C2=CC=CC=C2)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

C1[C@H](C[C@H](O[C@H]1C2=CC=CC=C2)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H16ClNO/c19-16-10-17(14-4-2-1-3-5-14)21-18(11-16)15-8-6-13(12-20)7-9-15/h1-9,16-18H,10-11H2/t16-,17-,18+/m1/s1