4-(3-imidazol-1-ylpropylamino)-3-nitro-benzamide

Systemtic Name: 4-(3-imidazol-1-ylpropylamino)-3-nitro-benzamide Openeye Name: 4-(3-imidazol-1-ylpropylamino)-3-nitro-benzamide CAS Name: 4-[3-(1-imidazolyl)propylamino]-3-nitrobenzamide IUPAC Name: 4-(3-imidazol-1-ylpropylamino)-3-nitrobenzamide Traditional Name: 4-(3-imidazol-1-ylpropylamino)-3-nitro-benzamide Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C13H15N5O3/c14-13(19)10-2-3-11(12(8-10)18(20)21)16-4-1-6-17-7-5-15-9-17/h2-3,5,7-9,16H,1,4,6H2,(H2,14,19)