4-(3-cyanophenoxy)-3-[(4-pyrrolidin-1-ylcarbonylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-(3-cyanophenoxy)-3-[(4-pyrrolidin-1-ylcarbonylphenyl)carbonylamino]butanoic acid Openeye Name: 4-(3-cyanophenoxy)-3-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]butanoic acid CAS Name: 4-(3-cyanophenoxy)-3-[[oxo-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]amino]butanoic acid IUPAC Name: 4-(3-cyanophenoxy)-3-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]butanoic acid Traditional Name: 4-(3-cyanophenoxy)-3-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]butyric acid Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)C(=O)NC(CC(=O)O)COC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)C(=O)NC(CC(=O)O)COC3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H23N3O5/c24-14-16-4-3-5-20(12-16)31-15-19(13-21(27)28)25-22(29)17-6-8-18(9-7-17)23(30)26-10-1-2-11-26/h3-9,12,19H,1-2,10-11,13,15H2,(H,25,29)(H,27,28)