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

Systemtic Name: 2-[1-(5-chloranyl-2-methyl-phenyl)-2-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(5-chloro-2-methyl-phenyl)-2-(4-ethoxyphenyl)-4-oxo-azetidin-3-yl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(5-chloro-2-methylphenyl)-2-(4-ethoxyphenyl)-4-oxo-3-azetidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(5-chloro-2-methylphenyl)-2-(4-ethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[1-(5-chloro-2-methyl-phenyl)-2-keto-4-p-phenetyl-azetidin-3-yl]-5-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=C(C=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=C(C=C5)[N+](=O)[O-]

InChI

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