2-[(R)-[(3S)-3-methyl-4-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]-phenyl-methyl]-2-prop-2-enyl-propanedinitrile

Systemtic Name: 2-[(R)-[(3S)-3-methyl-4-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]-phenyl-methyl]-2-prop-2-enyl-propanedinitrile Openeye Name: 2-allyl-2-[(R)-[(3S)-1-benzyl-3-methyl-4-oxo-3-piperidyl]-phenyl-methyl]propanedinitrile CAS Name: 2-[(R)-[(3S)-3-methyl-4-oxo-1-(phenylmethyl)-3-piperidinyl]-phenylmethyl]-2-prop-2-enylpropanedinitrile IUPAC Name: 2-[(R)-[(3S)-1-benzyl-3-methyl-4-oxopiperidin-3-yl]-phenylmethyl]-2-prop-2-enylpropanedinitrile Traditional Name: 2-allyl-2-[(R)-[(3S)-1-benzyl-4-keto-3-methyl-3-piperidyl]-phenyl-methyl]malononitrile Formula: C26H27N3O MolecularWeight: 397.51208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCC1=O)CC2=CC=CC=C2)C(C3=CC=CC=C3)C(CC=C)(C#N)C#N

Isomeric SMILES

C[C@@]1(CN(CCC1=O)CC2=CC=CC=C2)[C@H](C3=CC=CC=C3)C(CC=C)(C#N)C#N

InChI

InChI=1S/C26H27N3O/c1-3-15-26(18-27,19-28)24(22-12-8-5-9-13-22)25(2)20-29(16-14-23(25)30)17-21-10-6-4-7-11-21/h3-13,24H,1,14-17,20H2,2H3/t24-,25-/m0/s1