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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

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