methyl 3-[4-[3-(4-cyanophenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate hydrochloride

Systemtic Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate hydrochloride Openeye Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxo-imidazolidin-1-yl]phenyl]propanoate hydrochloride CAS Name: 3-[4-[3-(4-cyanophenyl)-2-oxo-1-imidazolidinyl]phenyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxoimidazolidin-1-yl]phenyl]propanoate hydrochloride Traditional Name: 3-[4-[3-(4-cyanophenyl)-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester hydrochloride Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C#N.Cl

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C#N.Cl

InChI

InChI=1S/C20H19N3O3.ClH/c1-26-19(24)11-6-15-2-7-17(8-3-15)22-12-13-23(20(22)25)18-9-4-16(14-21)5-10-18;/h2-5,7-10H,6,11-13H2,1H3;1H