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

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: N-[2-(4-chlorobenzyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Formula: C21H14ClN3O4 MolecularWeight: 407.80656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN3O4/c22-15-6-4-13(5-7-15)10-20-24-18-12-16(8-9-19(18)29-20)23-21(26)14-2-1-3-17(11-14)25(27)28/h1-9,11-12H,10H2,(H,23,26)