2-chloranyl-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-4-nitro-benzamide Openeye Name: 2-chloro-4-nitro-N-[2-(o-tolyl)-1,3-benzoxazol-5-yl]benzamide CAS Name: 2-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-4-nitrobenzamide Traditional Name: 2-chloro-4-nitro-N-[2-(o-tolyl)-1,3-benzoxazol-5-yl]benzamide Formula: C21H14ClN3O4 MolecularWeight: 407.80656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H14ClN3O4/c1-12-4-2-3-5-15(12)21-24-18-10-13(6-9-19(18)29-21)23-20(26)16-8-7-14(25(27)28)11-17(16)22/h2-11H,1H3,(H,23,26)