(3S)-1-[2-(4-cyano-2-ethoxy-phenoxy)ethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-(4-cyano-2-ethoxy-phenoxy)ethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(4-cyano-2-ethoxy-phenoxy)acetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[2-(4-cyano-2-ethoxyphenoxy)-1-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(4-cyano-2-ethoxyphenoxy)acetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[2-(4-cyano-2-ethoxy-phenoxy)acetyl]-N-phenyl-nipecotamide Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-2-29-21-13-17(14-24)10-11-20(21)30-16-22(27)26-12-6-7-18(15-26)23(28)25-19-8-4-3-5-9-19/h3-5,8-11,13,18H,2,6-7,12,15-16H2,1H3,(H,25,28)/t18-/m0/s1