4-(3-cyanophenoxy)-3-[(4-cyanophenyl)carbonylamino]butanoate

Systemtic Name: 4-(3-cyanophenoxy)-3-[(4-cyanophenyl)carbonylamino]butanoate Openeye Name: 3-[(4-cyanobenzoyl)amino]-4-(3-cyanophenoxy)butanoate CAS Name: 4-(3-cyanophenoxy)-3-[[(4-cyanophenyl)-oxomethyl]amino]butanoate IUPAC Name: 3-[(4-cyanobenzoyl)amino]-4-(3-cyanophenoxy)butanoate Traditional Name: 3-[(4-cyanobenzoyl)amino]-4-(3-cyanophenoxy)butyrate Formula: C19H14N3O4- MolecularWeight: 348.33216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(CC(=O)[O-])NC(=O)C2=CC=C(C=C2)C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCC(CC(=O)[O-])NC(=O)C2=CC=C(C=C2)C#N)C#N

InChI

InChI=1S/C19H15N3O4/c20-10-13-4-6-15(7-5-13)19(25)22-16(9-18(23)24)12-26-17-3-1-2-14(8-17)11-21/h1-8,16H,9,12H2,(H,22,25)(H,23,24)/p-1