3-[(2R,6S)-2,6-bis(4-methoxyphenyl)-4-oxidanylidene-piperidin-1-yl]oxypropanenitrile

Systemtic Name: 3-[(2R,6S)-2,6-bis(4-methoxyphenyl)-4-oxidanylidene-piperidin-1-yl]oxypropanenitrile Openeye Name: 3-[[(2R,6S)-2,6-bis(4-methoxyphenyl)-4-oxo-1-piperidyl]oxy]propanenitrile CAS Name: 3-[[(2R,6S)-2,6-bis(4-methoxyphenyl)-4-oxo-1-piperidinyl]oxy]propanenitrile IUPAC Name: 3-[(2R,6S)-2,6-bis(4-methoxyphenyl)-4-oxopiperidin-1-yl]oxypropanenitrile Traditional Name: 3-[(2R,6S)-4-keto-2,6-bis(4-methoxyphenyl)piperidino]oxypropionitrile Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=O)CC(N2OCCC#N)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=O)C[C@H](N2OCCC#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O4/c1-26-19-8-4-16(5-9-19)21-14-18(25)15-22(24(21)28-13-3-12-23)17-6-10-20(27-2)11-7-17/h4-11,21-22H,3,13-15H2,1-2H3/t21-,22+