N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide Openeye Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide CAS Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitrobenzamide IUPAC Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitrobenzamide Traditional Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c1-13-11-18-20(12-14(13)2)29-22(24-18)15-7-9-16(10-8-15)23-21(26)17-5-3-4-6-19(17)25(27)28/h3-12H,1-2H3,(H,23,26)