(2S)-2-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-(3,4,5-trimethoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-(3,4,5-trimethoxyphenyl)ethanenitrile Openeye Name: (2S)-2-[(2-hydroxy-1,1-dimethyl-ethyl)amino]-2-(3,4,5-trimethoxyphenyl)acetonitrile CAS Name: (2S)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-(3,4,5-trimethoxyphenyl)acetonitrile IUPAC Name: (2S)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-(3,4,5-trimethoxyphenyl)acetonitrile Traditional Name: (2S)-2-[(2-hydroxy-1,1-dimethyl-ethyl)amino]-2-(3,4,5-trimethoxyphenyl)acetonitrile Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(C#N)C1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CC(C)(CO)N[C@H](C#N)C1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C15H22N2O4/c1-15(2,9-18)17-11(8-16)10-6-12(19-3)14(21-5)13(7-10)20-4/h6-7,11,17-18H,9H2,1-5H3/t11-/m1/s1