ethyl 2-[4-cyano-2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-cyano-2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenoxy]ethanoate Openeye Name: ethyl 2-[4-cyano-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetate CAS Name: 2-[4-cyano-2-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-cyano-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetate Traditional Name: 2-[4-cyano-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetic acid ethyl ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)C#N)NC(=O)C2=CC=C(C=C2)OCCCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)C#N)NC(=O)C2=CC=C(C=C2)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C28H28N2O5/c1-2-33-27(31)20-35-26-16-11-22(19-29)18-25(26)30-28(32)23-12-14-24(15-13-23)34-17-7-6-10-21-8-4-3-5-9-21/h3-5,8-9,11-16,18H,2,6-7,10,17,20H2,1H3,(H,30,32)