methyl 3-[4-[2-oxidanylidene-3-[1-(phenylmethyl)piperidin-4-yl]imidazolidin-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[2-oxidanylidene-3-[1-(phenylmethyl)piperidin-4-yl]imidazolidin-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-(1-benzyl-4-piperidyl)-2-oxo-imidazolidin-1-yl]phenyl]propanoate CAS Name: 3-[4-[2-oxo-3-[1-(phenylmethyl)-4-piperidinyl]-1-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(1-benzylpiperidin-4-yl)-2-oxoimidazolidin-1-yl]phenyl]propanoate Traditional Name: 3-[4-[3-(1-benzyl-4-piperidyl)-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3/c1-31-24(29)12-9-20-7-10-22(11-8-20)27-17-18-28(25(27)30)23-13-15-26(16-14-23)19-21-5-3-2-4-6-21/h2-8,10-11,23H,9,12-19H2,1H3