methyl 3-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[2-(4-cyano-2-ethoxyphenoxy)-1-oxoethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-cyano-2-ethoxyphenoxy)acetyl]amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

InChI

InChI=1S/C23H25N3O5/c1-3-30-21-12-16(14-24)6-9-20(21)31-15-22(27)25-18-13-17(23(28)29-2)7-8-19(18)26-10-4-5-11-26/h6-9,12-13H,3-5,10-11,15H2,1-2H3,(H,25,27)