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

Systemtic Name: 2-chloranyl-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-(4-chlorobenzyl)-1,3-benzoxazol-5-yl]-5-nitro-benzamide Formula: C21H13Cl2N3O4 MolecularWeight: 442.25162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C21H13Cl2N3O4/c22-13-3-1-12(2-4-13)9-20-25-18-10-14(5-8-19(18)30-20)24-21(27)16-11-15(26(28)29)6-7-17(16)23/h1-8,10-11H,9H2,(H,24,27)