2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonyl-1-(2-ethoxyphenyl)pyrrole-3-carbonitrile

Systemtic Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonyl-1-(2-ethoxyphenyl)pyrrole-3-carbonitrile Openeye Name: 2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]-1-(2-ethoxyphenyl)pyrrole-3-carbonitrile CAS Name: 2-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]-oxomethyl]-1-(2-ethoxyphenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]-1-(2-ethoxyphenyl)pyrrole-3-carbonitrile Traditional Name: 2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]-1-o-phenetyl-pyrrole-3-carbonitrile Formula: C20H23N3O3 MolecularWeight: 353.41492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C=CC(=C2C(=O)N3CC(OC(C3)C)C)C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2C=CC(=C2C(=O)N3C[C@@H](O[C@H](C3)C)C)C#N

InChI

InChI=1S/C20H23N3O3/c1-4-25-18-8-6-5-7-17(18)23-10-9-16(11-21)19(23)20(24)22-12-14(2)26-15(3)13-22/h5-10,14-15H,4,12-13H2,1-3H3/t14-,15-/m0/s1