N-[3-(cyclopropylmethoxy)propyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[3-(cyclopropylmethoxy)propyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[3-(cyclopropylmethoxy)propyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[3-(cyclopropylmethoxy)propyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[3-(cyclopropylmethoxy)propyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[3-(cyclopropylmethoxy)propyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COCCCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1COCCCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c22-17(19-6-1-9-25-11-13-2-3-13)14-4-5-15(16(10-14)21(23)24)20-8-7-18-12-20/h4-5,7-8,10,12-13H,1-3,6,9,11H2,(H,19,22)