4-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide

Systemtic Name: 4-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide Openeye Name: 4-[(2-isopropyl-5-methyl-phenoxy)methyl]-N-[(E)-(2-nitrophenyl)methyleneamino]benzamide CAS Name: 4-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide IUPAC Name: 4-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide Traditional Name: 4-[(2-isopropyl-5-methyl-phenoxy)methyl]-N-[(E)-(2-nitrobenzylidene)amino]benzamide Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=CC=C(C=C2)C(=O)NN=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O4/c1-17(2)22-13-8-18(3)14-24(22)32-16-19-9-11-20(12-10-19)25(29)27-26-15-21-6-4-5-7-23(21)28(30)31/h4-15,17H,16H2,1-3H3,(H,27,29)/b26-15+