methyl 3-[4-[3-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[3-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-[(1E)-1-hydroxyiminoindan-5-yl]-2-oxo-imidazolidin-1-yl]phenyl]propanoate CAS Name: 3-[4-[3-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-2-oxoimidazolidin-1-yl]phenyl]propanoate Traditional Name: 3-[4-[3-[(1E)-1-hydroximinoindan-5-yl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC4=C(C=C3)C(=NO)CC4

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC4=C(C=C3)/C(=N/O)/CC4

InChI

InChI=1S/C22H23N3O4/c1-29-21(26)11-4-15-2-6-17(7-3-15)24-12-13-25(22(24)27)18-8-9-19-16(14-18)5-10-20(19)23-28/h2-3,6-9,14,28H,4-5,10-13H2,1H3/b23-20+