2-azanyl-N-(3-imidazol-1-yl-2-methyl-propyl)-5-nitro-benzamide

Systemtic Name: 2-azanyl-N-(3-imidazol-1-yl-2-methyl-propyl)-5-nitro-benzamide Openeye Name: 2-amino-N-(3-imidazol-1-yl-2-methyl-propyl)-5-nitro-benzamide CAS Name: 2-amino-N-[3-(1-imidazolyl)-2-methylpropyl]-5-nitrobenzamide IUPAC Name: 2-amino-N-(3-imidazol-1-yl-2-methylpropyl)-5-nitrobenzamide Traditional Name: 2-amino-N-(3-imidazol-1-yl-2-methyl-propyl)-5-nitro-benzamide Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N)CN2C=CN=C2

Isomeric SMILES

CC(CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N)CN2C=CN=C2

InChI

InChI=1S/C14H17N5O3/c1-10(8-18-5-4-16-9-18)7-17-14(20)12-6-11(19(21)22)2-3-13(12)15/h2-6,9-10H,7-8,15H2,1H3,(H,17,20)