N-(benzimidazol-1-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-(benzimidazol-1-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-(benzimidazol-1-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-(1-benzimidazolyl)-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-(benzimidazol-1-yl)-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-(benzimidazol-1-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)NN2C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)NN2C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c1-26-9-8-18-14-7-6-12(10-16(14)22(24)25)17(23)20-21-11-19-13-4-2-3-5-15(13)21/h2-7,10-11,18H,8-9H2,1H3,(H,20,23)