N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[2-(4-butylphenyl)-6-methyl-5-benzotriazolyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[2-(4-butylphenyl)-6-methylbenzotriazol-5-yl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-5-(3-nitrophenyl)-2-furamide Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-])C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-])C

InChI

InChI=1S/C28H25N5O4/c1-3-4-6-19-9-11-21(12-10-19)32-30-24-15-18(2)23(17-25(24)31-32)29-28(34)27-14-13-26(37-27)20-7-5-8-22(16-20)33(35)36/h5,7-17H,3-4,6H2,1-2H3,(H,29,34)