2-(5-nitro-2-propan-2-yl-phenyl)-5-phenyl-1,3-benzoxazole

Systemtic Name: 2-(5-nitro-2-propan-2-yl-phenyl)-5-phenyl-1,3-benzoxazole Openeye Name: 2-(2-isopropyl-5-nitro-phenyl)-5-phenyl-1,3-benzoxazole CAS Name: 2-(5-nitro-2-propan-2-ylphenyl)-5-phenyl-1,3-benzoxazole IUPAC Name: 2-(5-nitro-2-propan-2-ylphenyl)-5-phenyl-1,3-benzoxazole Traditional Name: 2-(2-isopropyl-5-nitro-phenyl)-5-phenyl-1,3-benzoxazole Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3/c1-14(2)18-10-9-17(24(25)26)13-19(18)22-23-20-12-16(8-11-21(20)27-22)15-6-4-3-5-7-15/h3-14H,1-2H3