N-[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-[[3-(1-imidazolyl)propylamino]-oxomethyl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]-5-nitro-2-furamide Formula: C18H17N5O5 MolecularWeight: 383.35808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCN2C=CN=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCN2C=CN=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O5/c24-17(20-8-3-10-22-11-9-19-12-22)13-4-1-2-5-14(13)21-18(25)15-6-7-16(28-15)23(26)27/h1-2,4-7,9,11-12H,3,8,10H2,(H,20,24)(H,21,25)