(2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile CAS Name: (2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile Traditional Name: (2S)-2-(3-methoxypropylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(C#N)C1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O4/c1-18-7-5-6-17-12(10-16)11-8-13(19-2)15(21-4)14(9-11)20-3/h8-9,12,17H,5-7H2,1-4H3/t12-/m1/s1