N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-nitro-2-furamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O4/c1-2-3-4-14-5-8-16(9-6-14)25-23-17-10-7-15(13-18(17)24-25)22-21(27)19-11-12-20(30-19)26(28)29/h5-13H,2-4H2,1H3,(H,22,27)