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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

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