methyl 4-[2-[4-(4-cyano-2-methoxy-phenoxy)butanoylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[4-(4-cyano-2-methoxy-phenoxy)butanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[4-(4-cyano-2-methoxy-phenoxy)butanoylamino]ethyl]benzoate CAS Name: 4-[2-[[4-(4-cyano-2-methoxyphenoxy)-1-oxobutyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[4-(4-cyano-2-methoxyphenoxy)butanoylamino]ethyl]benzoate Traditional Name: 4-[2-[4-(4-cyano-2-methoxy-phenoxy)butanoylamino]ethyl]benzoic acid methyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCCCC(=O)NCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCCCC(=O)NCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H24N2O5/c1-27-20-14-17(15-23)7-10-19(20)29-13-3-4-21(25)24-12-11-16-5-8-18(9-6-16)22(26)28-2/h5-10,14H,3-4,11-13H2,1-2H3,(H,24,25)