N-(3-chloranyl-4-methoxy-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H12ClN5O4 MolecularWeight: 373.75058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12ClN5O4/c1-26-15-5-3-11(7-12(15)17)20-16(23)10-2-4-13(14(6-10)22(24)25)21-9-18-8-19-21/h2-9H,1H3,(H,20,23)