2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-3-methyl-butanenitrile

Systemtic Name: 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-3-methyl-butanenitrile Openeye Name: 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-3-methyl-butanenitrile CAS Name: 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methylamino]-3-methylbutanenitrile IUPAC Name: 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methylamino]-3-methylbutanenitrile Traditional Name: 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-3-methyl-butyronitrile Formula: C18H26N2O2 MolecularWeight: 302.41124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)N(C)C1COC(OC1C2=CC=CC=C2)(C)C

Isomeric SMILES

CC(C)C(C#N)N(C)[C@H]1COC(O[C@H]1C2=CC=CC=C2)(C)C

InChI

InChI=1S/C18H26N2O2/c1-13(2)15(11-19)20(5)16-12-21-18(3,4)22-17(16)14-9-7-6-8-10-14/h6-10,13,15-17H,12H2,1-5H3/t15?,16-,17-/m0/s1