N-(2-acetamidoethyl)-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(2-acetamidoethyl)-4-(methylamino)-3-nitro-benzamide Openeye Name: N-(2-acetamidoethyl)-4-(methylamino)-3-nitro-benzamide CAS Name: N-(2-acetamidoethyl)-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(2-acetamidoethyl)-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(2-acetamidoethyl)-4-(methylamino)-3-nitro-benzamide Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC(=C(C=C1)NC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC(=C(C=C1)NC)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4/c1-8(17)14-5-6-15-12(18)9-3-4-10(13-2)11(7-9)16(19)20/h3-4,7,13H,5-6H2,1-2H3,(H,14,17)(H,15,18)