2-[1-(3-chloranyl-2-methyl-phenyl)-2-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[1-(3-chloranyl-2-methyl-phenyl)-2-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(3-chloro-2-methyl-phenyl)-2-(4-ethoxyphenyl)-4-oxo-azetidin-3-yl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(3-chloro-2-methylphenyl)-2-(4-ethoxyphenyl)-4-oxo-3-azetidinyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(3-chloro-2-methylphenyl)-2-(4-ethoxyphenyl)-4-oxoazetidin-3-yl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[1-(3-chloro-2-methyl-phenyl)-2-keto-4-p-phenetyl-azetidin-3-yl]-4-nitro-isoindoline-1,3-quinone Formula: C26H20ClN3O6 MolecularWeight: 505.9065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H20ClN3O6/c1-3-36-16-12-10-15(11-13-16)22-23(26(33)28(22)19-8-5-7-18(27)14(19)2)29-24(31)17-6-4-9-20(30(34)35)21(17)25(29)32/h4-13,22-23H,3H2,1-2H3