N-[2-(2-acetamidoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[2-(2-acetamidoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide Openeye Name: N-[2-(2-acetamidoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide CAS Name: N-[2-(2-acetamidoethyl)-1-methyl-5-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[2-(2-acetamidoethyl)-1-methylbenzimidazol-5-yl]-3-nitrobenzamide Traditional Name: N-[2-(2-acetamidoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=NC2=C(N1C)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCCC1=NC2=C(N1C)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4/c1-12(25)20-9-8-18-22-16-11-14(6-7-17(16)23(18)2)21-19(26)13-4-3-5-15(10-13)24(27)28/h3-7,10-11H,8-9H2,1-2H3,(H,20,25)(H,21,26)