2-(2-acetamidoethyliminomethyl)-4-nitro-phenolate

Systemtic Name: 2-(2-acetamidoethyliminomethyl)-4-nitro-phenolate Openeye Name: 2-(2-acetamidoethyliminomethyl)-4-nitro-phenolate CAS Name: 2-(2-acetamidoethyliminomethyl)-4-nitrophenolate IUPAC Name: 2-(2-acetamidoethyliminomethyl)-4-nitrophenolate Traditional Name: 2-(2-acetamidoethyliminomethyl)-4-nitro-phenolate Formula: C11H12N3O4- MolecularWeight: 250.23068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-]

Isomeric SMILES

CC(=O)NCCN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-]

InChI

InChI=1S/C11H13N3O4/c1-8(15)13-5-4-12-7-9-6-10(14(17)18)2-3-11(9)16/h2-3,6-7,16H,4-5H2,1H3,(H,13,15)/p-1