4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Openeye Name: 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide CAS Name: 4-(4-chloro-2-nitrophenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide IUPAC Name: 4-(4-chloro-2-nitrophenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Formula: C23H18ClN5O5 MolecularWeight: 479.87252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN5O5/c1-33-22-10-16(4-8-21(22)34-20-9-5-17(24)11-19(20)29(31)32)23(30)27-18-6-2-15(3-7-18)12-28-14-25-13-26-28/h2-11,13-14H,12H2,1H3,(H,27,30)