N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-ethoxy-3-nitro-benzamide Formula: C25H24ClN5O4 MolecularWeight: 493.94216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC(=C(C=C4)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC(=C(C=C4)OCC)[N+](=O)[O-]

InChI

InChI=1S/C25H24ClN5O4/c1-3-5-6-16-7-10-18(11-8-16)30-28-21-14-19(26)20(15-22(21)29-30)27-25(32)17-9-12-24(35-4-2)23(13-17)31(33)34/h7-15H,3-6H2,1-2H3,(H,27,32)