5-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-nitro-benzoic acid

Systemtic Name: 5-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-nitro-benzoic acid Openeye Name: 5-[methyl-[2-(methylamino)-2-oxo-ethyl]amino]-2-nitro-benzoic acid CAS Name: 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-nitrobenzoic acid IUPAC Name: 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-nitrobenzoic acid Traditional Name: 5-[[2-keto-2-(methylamino)ethyl]-methyl-amino]-2-nitro-benzoic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O5/c1-12-10(15)6-13(2)7-3-4-9(14(18)19)8(5-7)11(16)17/h3-5H,6H2,1-2H3,(H,12,15)(H,16,17)