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

Systemtic Name: 4-[(2S,4R,6R)-4-chloranyl-4-methyl-6-phenyl-oxan-2-yl]benzenecarbonitrile Openeye Name: 4-[(2S,4R,6R)-4-chloro-4-methyl-6-phenyl-tetrahydropyran-2-yl]benzonitrile CAS Name: 4-[(2S,4R,6R)-4-chloro-4-methyl-6-phenyl-2-oxanyl]benzonitrile IUPAC Name: 4-[(2S,4R,6R)-4-chloro-4-methyl-6-phenyloxan-2-yl]benzonitrile Traditional Name: 4-[(2S,4R,6R)-4-chloro-4-methyl-6-phenyl-tetrahydropyran-2-yl]benzonitrile Formula: C19H18ClNO MolecularWeight: 311.80532

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(OC(C1)C2=CC=C(C=C2)C#N)C3=CC=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClNO/c1-19(20)11-17(15-5-3-2-4-6-15)22-18(12-19)16-9-7-14(13-21)8-10-16/h2-10,17-18H,11-12H2,1H3/t17-,18+,19-/m1/s1