methyl 3-[4-[3-(4-cyano-2-methoxy-phenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-cyano-2-methoxy-phenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-(4-cyano-2-methoxy-phenyl)-2-oxo-imidazolidin-1-yl]phenyl]propanoate CAS Name: 3-[4-[3-(4-cyano-2-methoxyphenyl)-2-oxo-1-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-cyano-2-methoxyphenyl)-2-oxoimidazolidin-1-yl]phenyl]propanoate Traditional Name: 3-[4-[3-(4-cyano-2-methoxy-phenyl)-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C21H21N3O4/c1-27-19-13-16(14-22)5-9-18(19)24-12-11-23(21(24)26)17-7-3-15(4-8-17)6-10-20(25)28-2/h3-5,7-9,13H,6,10-12H2,1-2H3