N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide Openeye Name: N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide CAS Name: N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide IUPAC Name: N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide Traditional Name: N-[1-(2,4-dichlorobenzyl)-1,2,4-triazol-3-yl]-4-nitro-benzamide Formula: C16H11Cl2N5O3 MolecularWeight: 392.19624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11Cl2N5O3/c17-12-4-1-11(14(18)7-12)8-22-9-19-16(21-22)20-15(24)10-2-5-13(6-3-10)23(25)26/h1-7,9H,8H2,(H,20,21,24)