4-(benzotriazol-1-ylmethyl)-N-(4-ethyl-3-nitro-phenyl)benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-(4-ethyl-3-nitro-phenyl)benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-(4-ethyl-3-nitro-phenyl)benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-(4-ethyl-3-nitrophenyl)benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-(4-ethyl-3-nitrophenyl)benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-(4-ethyl-3-nitro-phenyl)benzamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O3/c1-2-16-11-12-18(13-21(16)27(29)30)23-22(28)17-9-7-15(8-10-17)14-26-20-6-4-3-5-19(20)24-25-26/h3-13H,2,14H2,1H3,(H,23,28)