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

Systemtic Name: 4-chloranyl-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(4-chlorobenzyl)-1,3-benzoxazol-5-yl]-3-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=CC(=C(C=C4)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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