2-[1-(4-chlorophenyl)-2-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[1-(4-chlorophenyl)-2-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(4-chlorophenyl)-2-(4-ethoxyphenyl)-4-oxo-azetidin-3-yl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(4-chlorophenyl)-2-(4-ethoxyphenyl)-4-oxo-3-azetidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(4-chlorophenyl)-2-(4-ethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[1-(4-chlorophenyl)-2-keto-4-p-phenetyl-azetidin-3-yl]-5-nitro-isoindoline-1,3-quinone Formula: C25H18ClN3O6 MolecularWeight: 491.87992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(=O)N2C3=CC=C(C=C3)Cl)N4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(=O)N2C3=CC=C(C=C3)Cl)N4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H18ClN3O6/c1-2-35-18-10-3-14(4-11-18)21-22(25(32)27(21)16-7-5-15(26)6-8-16)28-23(30)19-12-9-17(29(33)34)13-20(19)24(28)31/h3-13,21-22H,2H2,1H3