(2S)-1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]acetyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[2-(homoveratrylamino)acetyl]pyrrolidine-2-carbonitrile Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(=O)N2CCCC2C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(=O)N2CCC[C@H]2C#N)OC

InChI

InChI=1S/C17H23N3O3/c1-22-15-6-5-13(10-16(15)23-2)7-8-19-12-17(21)20-9-3-4-14(20)11-18/h5-6,10,14,19H,3-4,7-9,12H2,1-2H3/t14-/m0/s1