4-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-keto-2-[(2S)-2-methylpiperidino]ethoxy]phenyl]benzonitrile Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H22N2O2/c1-16-4-2-3-13-23(16)21(24)15-25-20-11-9-19(10-12-20)18-7-5-17(14-22)6-8-18/h5-12,16H,2-4,13,15H2,1H3/t16-/m0/s1